![4-[4-Chloro-3-(trifluoromethyl)benzenesulfonamido]butanoic acid structure](/static/products/6120/612043-44-4.webp)
4-[4-Chloro-3-(trifluoromethyl)benzenesulfonamido]butanoic acid
TL;DR: 4-[4-Chloro-3-(trifluoromethyl)benzenesulfonamido]butanoic acid (CAS 612043-44-4) is a chemical compound with molecular formula C11H11ClF3NO4S and molecular weight 345.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[[4-chloro-3-(trifluoromethyl)phenyl]sulfonylamino]butanoic acid
Also Known As: 4-[4-chloro-3-(trifluoromethyl)benzenesulfonamido]butanoic acid, 4-({[4-chloro-3-(trifluoromethyl)phenyl]sulfonyl}amino)butanoic acid, 4-[[4-chloro-3-(trifluoromethyl)phenyl]sulfonylamino]butanoic Acid, AB01326741-02, AS-871/41610677
| Molecular Formula | C11H11ClF3NO4S |
|---|---|
| Molecular Weight | 345.00 g/mol |
| LogP | 2.5019 |
| Topological Polar Surface Area | 83.47 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 345.00494 |
| Heavy Atoms | 21 |
| Complexity | 630.84576 |
Chemical Identifiers
| CAS Number | 612043-44-4 |
|---|---|
| SMILES | C1=CC(=C(C=C1S(=O)(=O)NCCCC(=O)O)C(F)(F)F)Cl |
Product Overview
4-[4-Chloro-3-(trifluoromethyl)benzenesulfonamido]butanoic acid (CAS 612043-44-4), with molecular formula C11H11ClF3NO4S and molecular weight 345.00 g/mol. IUPAC: 4-[[4-chloro-3-(trifluoromethyl)phenyl]sulfonylamino]butanoic acid.
Chemical Property Profile of 4-[4-Chloro-3-(trifluoromethyl)benzenesulfonamido]butanoic acid
Property Insights of 4-[4-Chloro-3-(trifluoromethyl)benzenesulfonamido]butanoic acid
The XLogP value of 2.5019 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-[4-Chloro-3-(trifluoromethyl)benzenesulfonamido]butanoic acid. The TPSA of 83.47 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-[4-Chloro-3-(trifluoromethyl)benzenesulfonamido]butanoic acid. Following Lipinski's Rule of Five, 4-[4-Chloro-3-(trifluoromethyl)benzenesulfonamido]butanoic acid 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 4-[4-Chloro-3-(trifluoromethyl)benzenesulfonamido]butanoic acid?
The CAS number of 4-[4-Chloro-3-(trifluoromethyl)benzenesulfonamido]butanoic acid is 612043-44-4.
What is the molecular formula of 4-[4-Chloro-3-(trifluoromethyl)benzenesulfonamido]butanoic acid?
The molecular formula of 4-[4-Chloro-3-(trifluoromethyl)benzenesulfonamido]butanoic acid is C11H11ClF3NO4S.
What is the molecular weight of 4-[4-Chloro-3-(trifluoromethyl)benzenesulfonamido]butanoic acid?
The molecular weight of 4-[4-Chloro-3-(trifluoromethyl)benzenesulfonamido]butanoic acid is 345.00 g/mol.
Where can I buy 4-[4-Chloro-3-(trifluoromethyl)benzenesulfonamido]butanoic acid?
You can request a quote for 4-[4-Chloro-3-(trifluoromethyl)benzenesulfonamido]butanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-[4-Chloro-3-(trifluoromethyl)benzenesulfonamido]butanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-[4-Chloro-3-(trifluoromethyl)benzenesulfonamido]butanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.