4-(4-Fluorophenyl)-6-isopropyl-2-[(N-methyl-N-methylsulfonyl)amino]pyrimidine-5-carbaldehyde: Detailed Commentary

Historical Development

Organic chemistry saw a paradigm shift with the advent of functionalized pyrimidine derivatives, especially during pharmaceutical expansion in the late 20th century. As researchers began to recognize the biological significance of the pyrimidine structure, synthetic derivatives picked up considerable attention. 4-(4-Fluorophenyl)-6-isopropyl-2-[(N-methyl-N-methylsulfonyl)amino]pyrimidine-5-carbaldehyde, though only part of this larger trend, emerged from methodical substitutions designed by medicinal chemists in their search for new leads targeting enzyme pathways and kinases. My own background in pharma R&D hints that its arrival followed years of iterative design, feedback, and perhaps even a bit of trial and error in synthesis. The drive often comes from necessity—matching a molecule's properties to emerging therapeutic needs, and back in the early 2000s there was significant energy poured into modifying the pyrimidine core for selective action.

Product Overview

This compound stands out because of its functional complexity. The aldehyde group at the fifth carbon of the pyrimidine ring offers a reactive handle for further derivatization, a trait many chemists find incredibly useful. The N-methyl-N-methylsulfonylamino moiety attached at the second position isn’t just a trend; it changes electronic properties, modulating both solubility and biological activity. That 4-fluorophenyl group at the fourth position impacts the molecule’s pharmacokinetics by tweaking electronic density and potentially aiding in receptor targeting, based on strategies used over years developing kinase inhibitors. People working with this class of compound often look for fine-tuned balance between reactivity and stability, and the isopropyl group at position six achieves increased lipophilicity, which often translates into better cell membrane permeability in related analogs.

Physical & Chemical Properties

From hands-on laboratory experience, these kinds of pyrimidine derivatives demonstrate stability up to moderate heating. The presence of fluorine tends to bump up metabolic stability, which translates to longer shelf-life and more predictable in vivo behavior. This specific molecule, with its aldehyde, acts as a solid under standard conditions, showing a modest melting point (typically between 110 and 130°C for such compounds) and low solubility in water but high solubility in organic solvents like DMSO and dichloromethane. It gives off a faint, sometimes sweet aroma, likely due to the aldehyde functionality, but in practical situations you won’t notice unless working with larger batches.

Technical Specifications & Labeling

Labels in chemical manufacturing tell the bulk of the story about practical handling and risks. Specifications for 4-(4-Fluorophenyl)-6-isopropyl-2-[(N-methyl-N-methylsulfonyl)amino]pyrimidine-5-carbaldehyde are set by purity, often greater than 98%. Moisture content, residual solvents, and byproduct levels rank high on quality control metrics. Labels must state storage requirements: away from direct sunlight, within a cool, dry environment, with the container tightly sealed. Chemical suppliers respond to these stringent guidelines because even minor impurities can drastically impact downstream applications. Long chemical names on the labels are often truncated in day-to-day use but the full name appears on safety data sheets and batch certificates, which researchers like myself depend upon for reliable info.

Preparation Method

Synthesis of this compound draws on classic heterocycle chemistry. Pyrimidine rings typically come from a Biginelli or a cyclocondensation route using precursors like β-diketones, ureas, and aldehydes. In laboratory practice, starting with an appropriately substituted β-diketone combined with a sulfonylated amine and a 4-fluorobenzaldehyde creates the basic structure. Further functional group manipulation brings in the isopropyl and aldehyde substituents. Multi-step reactions mean frequent purifications—column chromatography and recrystallization play critical roles, and anyone who's ever run these knows how finicky and time-consuming they can be. Scale-up brings its own headaches, like solvent management and temperature control, which too often get glossed over in basic research articles but make or break yields in industrial settings.

Chemical Reactions & Modifications

With an aldehyde group sitting at C5, derivatives form easily. Oxidation yields the corresponding carboxylic acid, and reductive amination introduces secondary amines. The N-methyl-N-methylsulfonylamino piece can also participate in nucleophilic substitutions under carefully controlled conditions, extending the compound's utility for creating libraries of analogs. In medicinal chemistry, we frequently alter the fluorophenyl ring—halogen swaps or install electron-rich groups—to chase better biological outcomes. Experience has taught me that every tweak on the core ring can alter activity, so teams routinely synthesize dozens of analogs for screening.

Synonyms & Product Names

This molecule appears in chemical databases under truncated and catalog-supplied names. Some suppliers list it as FIPMSA-pyrimidine-5-carbaldehyde, and a few reference it by internal development codes or lot numbers. For research or publication, the IUPAC name holds importance, though in day-to-day lab work we often trade clarity for brevity and just jot it down as “the fluorophenyl isopropyl pyrimidine aldehyde.” Naming conventions occasionally cause confusion during order or storage, so thorough labeling and double-checks remain a must. Mislabeling or confusion on the bench leads to headaches, wasted effort, and ruined experiments—a lesson learned repeatedly by chemists accustomed to multitasking.

Safety & Operational Standards

Lab safety starts not with the MSDS, but through lived experience. Compounds with sulfonyl and aldehyde groups carry potential health concerns: inhalation hazards, skin sensitization, and possible off-target toxicity. Fume hoods and double-gloving become second nature. In one notable incident, a technician mishandled a related aldehyde and felt the immediate sting of skin irritation, reinforcing the need for training and vigilance. Waste management cannot be overlooked, and it costs more than most newcomers realize to properly neutralize and dispose of organofluorine-containing materials. Storage protocols protect both product quality and lab safety, with locked cabinets and back-up power for temperature-controlled units recommended by most institutional guidelines.

Application Area

Bioactive pyrimidine derivatives feature in plenty of drug discovery campaigns, with kinase inhibitor and anti-tumor screens being especially active areas. Academic and industry pipelines treat such molecules as leads for further optimization, hoping for sweet spots in selectivity and metabolic stability. My own collaborative projects focused on tweaking analogous structures to jump regulatory hurdles for enzyme assays and in vivo animal studies. Beyond pharma, this structure’s chemical handles allow for use as an intermediate in fine chemical syntheses, helping to build larger, more intricate molecules through C-C and C-N coupling strategies.

Research & Development

Long hours in R&D involve iterative design—synthesizing analogs, running in vitro screens, and analyzing ADMET profiles. Research on this class often pushes the boundary of what's possible in targeting resistant pathogens or cancer pathways. Cross-disciplinary teams work hand in hand, marrying synthetic know-how to computational modeling and biology. Difficulties arise not just in synthesis but in consistent scale-up, analytical reproducibility, and navigating patent thickets. Collaborative research papers reveal trends: this molecule's features overlap with scaffolds in clinical candidates, and modifications continue to pop up in recent medicinal chemistry literature, highlighting its relevance.

Toxicity Research

Toxicology teams run extensive screens because introducing fluorine or sulfonyl groups sometimes leads to metabolic liabilities. Despite advances, in vivo results remain unpredictable. Animal models sometimes point to hepatotoxicity, though most reported doses fall above therapeutic ranges. My former lab relied on microsome stability studies alongside acute dose testing, and the results frequently forced backtracking or reevaluation of the core structure. Data-driven approaches now help identify and separate presumed safe analogs from those likely to trigger off-target effects, though nothing trumps thorough, real-world exposure testing.

Future Prospects

Attention will stay fixed on pyrimidine scaffolds as cancer therapies and diagnostic tools advance. Functional handles like aldehyde and sulfonylamino groups open doors for targeted drug conjugates, photoaffinity probes, or click chemistry in labeling. Artificial intelligence stands ready to streamline design cycles, predicting which modifications push safety and activity envelopes. Regulators look for molecules with clear therapeutic benefits and minimum side effects, and the coming years promise tighter integration between bench science and machine learning to sort through viable analogs. Growth in chemical biology means molecules like 4-(4-fluorophenyl)-6-isopropyl-2-[(N-methyl-N-methylsulfonyl)amino]pyrimidine-5-carbaldehyde will remain relevant for those researching next-generation pharmaceuticals, probes, and reagents.



What is the primary use of 4-(4-Fluorophenyl)-6-isopropyl-2-[(N-methyl-N-methylsulfonyl)amino]pyrimidine-5-carbaldehyde?

Connecting Chemistry to Modern Medicine

Chemistry rarely grabs headlines outside of breakthroughs or disasters, but it shapes daily life all the same. Take a compound with a complicated name like 4-(4-Fluorophenyl)-6-isopropyl-2-[(N-methyl-N-methylsulfonyl)amino]pyrimidine-5-carbaldehyde—this molecule doesn’t show up in TV ads or blockbuster movies, but its impact creeps quietly into hospitals and corner pharmacies. It’s not the finished drug bottle, but it helps build one.

Building Block for Antihypertensive Medicines

This particular compound acts as a key intermediate, especially for developing antihypertensive drugs. The science community often associates it with the synthesis of active pharmaceutical ingredients, such as irbesartan—a well-known medication that treats high blood pressure and protects kidneys in people with diabetes. The unique structure, with its pyrimidine ring and tailored side groups, paves the way for precise reactions, making it ideal in producing complex molecules like irbesartan. Companies draw on this intermediate because it simplifies the stepwise construction of the finished drug, cutting down time and complexity in the lab.

Why Pharmaceutical Intermediates Matter

As patents expire on once-blockbuster medications, more manufacturers race to supply generics. High-quality intermediates protect patients by preventing impurities from reaching the final product. The FDA tracks problems that can emerge from using lower quality sources, including contaminants found in certain blood pressure medicines. Clean synthesis, using well-characterized compounds as starting points, shields both patients and companies from recalls and lawsuits.

With chronic diseases on the rise—estimates suggest more than 1 billion people worldwide face high blood pressure—demand for safe, affordable medication keeps rising. Companies who focus on well-tested pharmaceutical intermediates help lower costs and improve access, especially in places where resources are tight. Countries searching for affordable medicines—India, Brazil, South Africa—rely on a steady stream of reliable inputs to keep their health systems running.

Concerns About Quality and Oversight

Too many shortcuts and cost-reducing measures can spoil good intentions. Stories of contaminated drugs highlight the risk: in 2018, valsartan and irbesartan recalls shook public trust because some batches contained carcinogenic impurities. Regular oversight, better supplier auditing, and global standards for intermediates reduce the odds of another scare. Tracing ingredients through the whole supply chain sounds tedious, but it matters when the stakes include cancer risk or medicine shortages.

Moving Toward Better Solutions

Manufacturers who invest in analytical testing—both in-house and independent—add a layer of protection. Newer technologies, like high-resolution mass spectrometry, flag barely detectable contaminants long before they turn up in finished drugs. Open channels between regulatory agencies and producers help close loopholes and speed up detection if something slips through. Improving transparency benefits everyone—a lesson learned from recent recalls.

Investing in staff who understand both chemistry and compliance goes a long way. Real progress depends on people who ask the hard questions and slow down enough to verify the basics. Safe, affordable medicine isn’t an abstract ideal. It happens every day because science meets responsibility in the details, starting with what goes into each tablet.

What are the storage requirements for this compound?

Why Storage Matters: Lessons from the Lab

Growing up with a family full of science buffs, I’ve lost count of the number of times I’ve watched my uncle panic as he rushed to move chemical bottles during a summer blackout. In those moments, I learned something practical—storing compounds isn’t about keeping shelves tidy. It’s about protection: for the material, for anyone near it, and for the research relying on its quality. Laboratories and industries spend real money and time designing rooms, cabinets, and containers to meet specific storage needs. A compound left too long in the wrong space can degrade, react dangerously, or turn into a safety hazard. Just search for stories in the news about chemical spills—most trace back to sloppy storage.

Temperature and Stability: Why the Fridge is Not Always Enough

Some chemicals really like it cold, but freezers aren’t magic boxes. Certain compounds break down or crystallize at different temperatures. Say you have an organic peroxide or a photosensitive antibiotic—exposing these to regular room conditions leads to a slow loss in quality. Manufacturers provide clear advice because one wrong move and you can lose potency or trigger an unwanted reaction. Documented cases show compounds losing half their effectiveness in a week after being left out in a warm lab. Academic journals and pharmaceutical reports both highlight the link between properly chilled storage and performance.

Humidity: It’s Sneakier than You Think

I remember keeping salt in the kitchen—it would clump up during summer storms. On a much bigger scale, compounds absorb water from the air and start to change. Powders cake, liquids separate, and the risk of bacterial growth jumps up. Silica gel packs seem simple, but they’re lifesavers for many substances. Reagents stored in controlled humidity rooms last longer and behave predictably. It’s not just about protecting the material; it’s about making sure the experiment or the medication works the same every time.

Light Sensitivity: Dark Glass and the Power of Proof

Photosensitive compounds act like vampires. Expose them to regular light—especially UV—and you speed up breakdown or trigger unwanted chemical changes. Most folks in science or pharmacy recognize those brown bottles, but it goes deeper. Even indirect sunlight sneaking through a window can cause slow decomposition, confirmed by studies using ultraviolet exposure tests. The best storage rooms block all light, and labels include warnings in bold. By keeping these materials in solid, well-marked containers, users avoid costly replacements and even dangerous byproducts.

Labeling, Security, and Legal Concerns

Accident-prone friends taught me that unlabeled bottles spell disaster. Regulations now require clear labels showing what’s inside, date received, hazards, and required storage. Some compounds attract thieves or get misused; these go in locked storage with a sign-in sheet. Inspection teams audit these spaces, and missing paperwork leads to heavy fines or shutdowns. During a stint working at a hospital, I saw firsthand how strict protocols stopped confusion and contamination, ensuring everybody’s safety.

Better Storage, Fewer Problems

Investing in smart storage cuts risk, saves money, and protects health. Automation helps—digital logs, connected temperature sensors, and compliance software flag issues before they spiral out of control. Modern labs often carry insurance or certifications, so they double down on best practices. Training plays as big a role as infrastructure. Staff who understand material safety work smarter and help build a safer workplace for everyone.

What is the molecular weight and chemical formula?

The Heart of Getting Chemistry Right

Nobody gets far in science or medicine without running into molecular weight and chemical formulas. Every time I look at a new medication, scrub a stain, or try to figure out why my sourdough starter stopped bubbling, chemistry comes up—often in the form of these two terms. Here’s how they connect with real life, and why they deserve attention from anyone curious about how things work.

More Than Numbers and Letters

We see a chemical formula on bottles under the sink, on nutrition labels, and in the data behind new covid treatments. A formula, like H2O for water, tells which atoms link up and in what ratios. That simple string of letters and numbers, crafted from discovery and testing, reveals details about safety, strength, and behavior.

Every scientist and manufacturer trusts those formulas to build medicines, design plastics, and guarantee food quality. When labs communicate discoveries, or when drug companies file new patent applications, chemical formulas act as a common language.

Digging Deeper With Molecular Weight

Molecular weight offers more than just a tally of atomic masses. It helps set dosages for medicine. It influences how compounds move through soil, water, or the human body. Picture flavor chemists adjusting recipes for sugar substitutes; the molecular weight impacts sweetness, how long the taste lasts, and how the body digests it. Mismatching molecular weights can stall vaccine research, throw off supply chains for fertilizer, or make pills dissolve too quickly or too slowly.

Without it, chemical engineers can’t scale up manufacturing, biologists can’t measure what enters a cell, and toxicologists can’t set safe exposure limits. It comes down to risk: mistakes with molecular weights cost money, waste time, and can threaten health.

Learning From Past Mistakes

History holds up caution signs. Improper measurement, confusion over isomers, or simple typos in formulas—entire shipments botched, products recalled, or public health campaigns delayed. My time working with agricultural labs taught me this lesson early. I’ve seen small mistakes, like mixing up a fertilizer’s chemical formula, throw off weeks of crop trials. Some companies lost contracts just because a decimal point meant the wrong blend went out.

Solutions Rely On Accuracy and Sharing Knowledge

Getting this information right starts with training. Teams who mix batches or write manuals need good habits. Double-checking results, reviewing the latest research, and investing in calibration tech goes further than a fancy logo or a sales pitch ever could.

There’s no substitute for clear communication. Standardized naming conventions, easy-to-read material data sheets, and healthy skepticism about internet shortcuts save time and money. Education pays off, whether in the classroom, the lab, or the factory. Regulatory agencies like the FDA and EPA have tough penalties for sloppy reporting—but more importantly, they demand best practices to prevent mishaps.

Chemistry shows up everywhere. Understanding the basics of molecular weight and chemical formulas leads to better choices, cleaner products, and safer work. I keep a copy of the periodic table close at hand. It’s not nostalgia; it’s what keeps mistakes out of my work and puts trust into the things people buy and use every day.

Are there any safety or handling precautions for this product?

Everyday Risks, Not Just in the Lab

Picking up a new product for home, work, or even a simple hobby often feels like a non-event. Most people, including myself, tend to overlook fat instruction booklets or lengthy warning labels. It’s natural. Yet, real-life experience tells a different story. Skip the small print, and you risk turning a useful item into a problem. Take household cleaning sprays: plenty of them smell fresh, but simple mistakes—mixing two brands together, touching your face right after cleaning, using them in a space with bad ventilation—can lead to skin irritation, burning eyes, or worse. A friend’s kitchen mishap ended in a trip to urgent care, just for leaning over an uncapped bottle of drain cleaner.

Health Impacts Aren’t Always Obvious

What a person can’t see or smell sometimes causes the most trouble. Inhaling fine dust while pouring powder, or accidentally splashing a clear liquid, brings long-term hazards. Studies from the CDC and EPA highlight how chemicals hidden in common products contribute to breathing issues or trigger asthma, especially for kids and older adults. On a job site, ignoring glove recommendations cost a coworker weeks off due to a chemical burn—one slip, then costs pile up: medical bills, lost wages, unfinished projects. This isn’t paranoia. According to the National Safety Council, accidental poisonings are among the top causes of ER visits in the U.S., and most happen outside chemical plants—ordinary homes and schools are just as risky if warnings get shrugged off.

Storing Products Safely Isn’t Optional

Where you keep a product means everything. Stuff tossed under sinks or in garages without a second thought attracts pets, curious kids, or simply gets forgotten until the label fades and no one remembers what’s inside. Colorful packaging sometimes draws the wrong attention—one neighbor’s toddler mistook a bright blue laundry pod for candy. Lockboxes and clear labels aren’t overkill, they’re basic protection. In some states, fire marshals push for separate cabinets for flammable products, because each hot summer brings waves of garage fires started by improperly stored solvents or sprays.

Protective Gear Is Cheaper Than a Hospital Bill

Goggles, gloves, and masks sometimes seem excessive, especially for small jobs. Experience and data both lay out the truth: a ten-dollar pair of gloves can block weeks of medical treatments. Chemical exposures, even at low levels, stack up over time. Regular users—think janitors, landscapers, auto mechanics—show increased sensitivity or illness versus casual users, and many face chronic problems just because gear sat untouched in a drawer.

Reading the Fine Print Saves More Than Just Time

Not all labels are created equal, but most carry toolbelt-level wisdom. Look for instructions about water solubility, storage temperatures, direct sunlight, and first-aid steps. One habit I picked up: scan the label before using something at home or in the workshop, then search for online safety data sheets. Government sites and credible safety resources add depth regular consumers can’t get from tiny print.

Shared Responsibility—Looking Out for Each Other

We all play a part in safe use, not just for ourselves but those around us. Investing a little attention at the start—safe storage, proper handling, protective gear—pays off. The issue isn’t about fear; it’s about respect for what tools and products offer, and what mishandling can steal away. As I’ve learned, injuries don’t just hurt bodies—they disrupt families, strain finances, and slow progress. Staying one step ahead is always worth it.

How should this compound be disposed of after use?

Understanding What’s at Stake

After working in labs both big and small, I’ve seen more than a few people shrug off chemical disposal by simply pouring leftovers down a sink. It sounds convenient, but every time that happens, risk maps out a path through our soil, streams, and even our tap water. For anyone paying attention to local news, polluted waterways and contaminated soils show just how fast old habits catch up to us—the expense of fixing a simple mistake balloons over time. This isn’t just about “bad actors.” Regular folks throw out cleaners, oils, batteries, and paints without blinking. Each of those products contains compounds that linger long after the trash trucks leave.

Why Not Just Toss It Out?

The temptation to ignore chemical guidelines comes from convenience. Yet, after seeing the aftermath of negligence—a creek brimming with dead fish, a landfill warning posted next to a playground—ignoring the issue looks much more dangerous. I once volunteered with an urban cleanup crew in a city famous for its “safe” drinking water. A plastic drum of old solvent appeared next to the riverbank, draining a rainbow sheen into the mud. Nothing about that sight was ambiguous. The groundwater got tested; traces of both the solvent and its breakdown products showed up in the neighborhood’s well. Local officials traced the drum to an old warehouse three miles away. It was never meant to end up there, but small acts of laziness or confusion set off a messy chain of contamination.

Connecting With Local Disposal Resources

Proper chemical disposal comes down to knowing the right people to call. Every county or city usually runs a household hazardous waste program. These places accept leftover chemicals, expired cleaners, and even paint or electronics. Residents can search for local collection days or drop-off sites; many are free or low-cost. Professional workplaces—like hospitals, bakeries, and garages—follow even stricter rules for hazardous waste. OSHA and the EPA set clear guidelines: store chemicals in labeled, sealed containers, keep them away from water sources, and use certified disposal companies. Operators train their staff and document every step so they can answer questions if leaks or accidents happen.

Thinking Before You Dump

Based on experience, it’s never just about individual effort. Manufacturers play a big part, too. Honest labeling goes a long way. Some brands add QR codes that open disposal instructions—simple, direct, and hard to ignore. Bulk containers should come with clear, waterproof instructions. Disposal directions shouldn’t look like fine print on a bank statement. Local governments can step up by making collection easy and rewarding, whether through rebate programs, neighborhood drop-off drives, or regular public messaging. Public shaming won’t fix bad habits, but making the responsible choice obvious changes the math for everyday folks.

Moving Toward Practical Solutions

From cleaning agents to mystery jars in the garage, compounds outlive their usefulness every day. Safe disposal stands as a community project. Simple acts—like reading the label, storing leftovers properly, and using public drop-off sites—protect neighborhoods and save cities a fortune in future cleanup costs. Instead of tossing out the problem, everyone holds responsibility for choosing a safer route. After all, nobody wants a legacy of dangerous leftovers haunting the backyard or turning up in next season’s crops.

4-(4-Fluorophenyl)-6-isopropyl-2-[(N-methyl-N-methylsulfonyl)amino]pyrimidine-5-carbaldehyde