4J-541S
TL;DR: 4J-541S (CAS 338424-16-1) is a chemical compound with molecular formula C17H15ClF3NO4S and molecular weight 421.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4-chlorophenyl)-2-hydroxy-2-methyl-3-[3-(trifluoromethyl)phenyl]sulfonylpropanamide
Also Known As: 4J-541S, N-(4-chlorophenyl)-2-hydroxy-2-methyl-3-{[3-(trifluoromethyl)phenyl]sulfonyl}propanamide, N-(4-chlorophenyl)-2-hydroxy-2-methyl-3-[3-(trifluoromethyl)benzenesulfonyl]propanamide, N-(4-chlorophenyl)-2-hydroxy-2-methyl-3-[3-(trifluoromethyl)phenyl]sulfonylpropanamide
| Molecular Formula | C17H15ClF3NO4S |
|---|---|
| Molecular Weight | 421.04 g/mol |
| LogP | 3.5222 |
| Topological Polar Surface Area | 83.47 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 421.03625 |
| Heavy Atoms | 27 |
| Complexity | 941.39606 |
Chemical Identifiers
| CAS Number | 338424-16-1 |
|---|---|
| SMILES | CC(CS(=O)(=O)C1=CC=CC(=C1)C(F)(F)F)(C(=O)NC2=CC=C(C=C2)Cl)O |
Product Overview
4J-541S (CAS 338424-16-1), with molecular formula C17H15ClF3NO4S and molecular weight 421.04 g/mol. IUPAC: N-(4-chlorophenyl)-2-hydroxy-2-methyl-3-[3-(trifluoromethyl)phenyl]sulfonylpropanamide.
Chemical Property Profile of 4J-541S
Property Insights of 4J-541S
The XLogP value of 3.5222 indicates that 4J-541S is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 83.47 Ų falls within the moderate polarity range, balancing permeability and solubility for 4J-541S. Following Lipinski's Rule of Five, 4J-541S has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4J-541S?
The CAS number of 4J-541S is 338424-16-1.
What is the molecular formula of 4J-541S?
The molecular formula of 4J-541S is C17H15ClF3NO4S.
What is the molecular weight of 4J-541S?
The molecular weight of 4J-541S is 421.04 g/mol.
Where can I buy 4J-541S?
You can request a quote for 4J-541S directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4J-541S?
Yes, KEHONG BIO provides custom synthesis services for 4J-541S and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.