Butanoic acid, 4-(((3-(trifluoromethyl)phenyl)sulfonyl)amino)-
TL;DR: Butanoic acid, 4-(((3-(trifluoromethyl)phenyl)sulfonyl)amino)- (CAS 85844-93-5) is a chemical compound with molecular formula C11H12F3NO4S and molecular weight 311.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[[3-(trifluoromethyl)phenyl]sulfonylamino]butanoic acid
Also Known As: 4-({[3-(trifluoromethyl)phenyl]sulfonyl}amino)butanoic acid, 4-((3-(Trifluoromethyl)phenyl)sulfonamido)butanoic acid, 4-(3-(Trifluoromethyl)phenylsulfonamido)butanoic acid, 4-[[3-(trifluoromethyl)phenyl]sulfonylamino]butanoic acid, 4-[3-(trifluoromethyl)benzenesulfonamido]butanoic acid
| Molecular Formula | C11H12F3NO4S |
|---|---|
| Molecular Weight | 311.04 g/mol |
| LogP | 1.8485 |
| Topological Polar Surface Area | 83.47 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 311.0439 |
| Heavy Atoms | 20 |
| Complexity | 583.5762 |
Chemical Identifiers
| CAS Number | 85844-93-5 |
|---|---|
| SMILES | C1=CC(=CC(=C1)S(=O)(=O)NCCCC(=O)O)C(F)(F)F |
Product Overview
Butanoic acid, 4-(((3-(trifluoromethyl)phenyl)sulfonyl)amino)- (CAS 85844-93-5), with molecular formula C11H12F3NO4S and molecular weight 311.04 g/mol. IUPAC: 4-[[3-(trifluoromethyl)phenyl]sulfonylamino]butanoic acid.
Chemical Property Profile of Butanoic acid, 4-(((3-(trifluoromethyl)phenyl)sulfonyl)amino)-
Property Insights of Butanoic acid, 4-(((3-(trifluoromethyl)phenyl)sulfonyl)amino)-
The XLogP value of 1.8485 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Butanoic acid, 4-(((3-(trifluoromethyl)phenyl)sulfonyl)amino)-. The TPSA of 83.47 Ų falls within the moderate polarity range, balancing permeability and solubility for Butanoic acid, 4-(((3-(trifluoromethyl)phenyl)sulfonyl)amino)-. Following Lipinski's Rule of Five, Butanoic acid, 4-(((3-(trifluoromethyl)phenyl)sulfonyl)amino)- has 2 hydrogen bond donor(s) and 3 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 Butanoic acid, 4-(((3-(trifluoromethyl)phenyl)sulfonyl)amino)-?
The CAS number of Butanoic acid, 4-(((3-(trifluoromethyl)phenyl)sulfonyl)amino)- is 85844-93-5.
What is the molecular formula of Butanoic acid, 4-(((3-(trifluoromethyl)phenyl)sulfonyl)amino)-?
The molecular formula of Butanoic acid, 4-(((3-(trifluoromethyl)phenyl)sulfonyl)amino)- is C11H12F3NO4S.
What is the molecular weight of Butanoic acid, 4-(((3-(trifluoromethyl)phenyl)sulfonyl)amino)-?
The molecular weight of Butanoic acid, 4-(((3-(trifluoromethyl)phenyl)sulfonyl)amino)- is 311.04 g/mol.
Where can I buy Butanoic acid, 4-(((3-(trifluoromethyl)phenyl)sulfonyl)amino)-?
You can request a quote for Butanoic acid, 4-(((3-(trifluoromethyl)phenyl)sulfonyl)amino)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Butanoic acid, 4-(((3-(trifluoromethyl)phenyl)sulfonyl)amino)-?
Yes, KEHONG BIO provides custom synthesis services for Butanoic acid, 4-(((3-(trifluoromethyl)phenyl)sulfonyl)amino)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.