Overview
4-(4-Fluorophenyl)-6-isopropyl-2-[N-(methylsulfonyl)methylamino]pyrimidine-5-carboxylic acid is a complex pyrimidine derivative with the CAS number 402497-81-8. This specialized organic compound features a fluorophenyl group and a methylsulfonylmethylamino substituent, making it potentially valuable as a building block in medicinal chemistry. As a research chemical, it's primarily used in pharmaceutical development and organic synthesis laboratories. The compound's structural features suggest possible applications in drug discovery programs targeting various biological pathways, though its specific pharmacological profile requires further investigation.
Physical and Chemical Properties
The compound has a molecular weight of 367.39 g/mol and the formula C16H18FN3O4S, indicating moderate complexity. The presence of both carboxylic acid and sulfonamide functional groups gives it potential for hydrogen bonding and ionic interactions. While detailed physical properties like melting point and solubility aren't widely reported, the compound's structure suggests it's likely a solid at room temperature with limited water solubility. The fluorophenyl moiety contributes to its lipophilicity, which can influence its behavior in biological systems and synthetic applications.
Main Applications
This chemical serves primarily as a specialized intermediate in pharmaceutical research and development. Its structural features make it potentially valuable for creating more complex molecules with biological activity, particularly in medicinal chemistry programs. In drug discovery, such compounds are often used as building blocks for kinase inhibitors or other small molecule therapeutics. The fluorophenyl group is particularly valuable in medicinal chemistry for its ability to modulate the pharmacokinetic properties of drug candidates.
Safety and Storage
As with many research chemicals, appropriate safety precautions should be taken when handling this compound. Standard laboratory safety equipment including gloves, goggles, and protective clothing are recommended to prevent skin contact or inhalation. The compound should be stored in a cool, dry place, preferably under inert atmosphere to maintain stability. Containers should be tightly sealed and labeled according to chemical safety regulations. Material Safety Data Sheets (MSDS) should be consulted for specific handling instructions.
B2B Procurement Guide
For B2B buyers, this compound is typically available in small quantities from specialty chemical suppliers that cater to pharmaceutical research and development. Given its specialized nature, lead times may be longer than for more common chemicals. When procuring, verify the supplier's analytical data (HPLC, NMR) to ensure purity and identity. Consider ordering small test quantities first for evaluation. Prices vary significantly based on quantity and purity requirements, with research-grade material typically costing more than bulk industrial chemicals.