![4-Amino-N-[3-(trifluoromethyl)phenyl]benzene-1-sulfonamide structure](/static/products/7597/7597-04-8.webp)
4-Amino-N-[3-(trifluoromethyl)phenyl]benzene-1-sulfonamide
TL;DR: 4-Amino-N-[3-(trifluoromethyl)phenyl]benzene-1-sulfonamide (CAS 7597-04-8) is a chemical compound with molecular formula C13H11F3N2O2S and molecular weight 316.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-amino-N-[3-(trifluoromethyl)phenyl]benzenesulfonamide
Also Known As: 4-Amino-N-(3-trifluoromethyl-phenyl)-benzenesulfonamide, 4-amino-N-[3-(trifluoromethyl)phenyl]benzenesulfonamide, Maybridge1_007142, N-alpha-Acetyl-DL-alanine, NCIOpen2_007612
| Molecular Formula | C13H11F3N2O2S |
|---|---|
| Molecular Weight | 316.05 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 80.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Exact Mass | 316.04935 |
| Heavy Atoms | 21 |
| Complexity | 439.0 |
Chemical Identifiers
| CAS Number | 7597-04-8 |
|---|---|
| SMILES | C1=CC(=CC(=C1)NS(=O)(=O)C2=CC=C(C=C2)N)C(F)(F)F |
| InChIKey | HLQMPESPBXMWOE-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-Amino-N-[3-(trifluoromethyl)phenyl]benzene-1-sulfonamide (CAS 7597-04-8), with molecular formula C13H11F3N2O2S and molecular weight 316.05 g/mol. IUPAC: 4-amino-N-[3-(trifluoromethyl)phenyl]benzenesulfonamide.
Chemical Property Profile of 4-Amino-N-[3-(trifluoromethyl)phenyl]benzene-1-sulfonamide
Property Insights of 4-Amino-N-[3-(trifluoromethyl)phenyl]benzene-1-sulfonamide
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Amino-N-[3-(trifluoromethyl)phenyl]benzene-1-sulfonamide. The TPSA of 80.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Amino-N-[3-(trifluoromethyl)phenyl]benzene-1-sulfonamide. Following Lipinski's Rule of Five, 4-Amino-N-[3-(trifluoromethyl)phenyl]benzene-1-sulfonamide has 2 hydrogen bond donor(s) and 7 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-Amino-N-[3-(trifluoromethyl)phenyl]benzene-1-sulfonamide?
The CAS number of 4-Amino-N-[3-(trifluoromethyl)phenyl]benzene-1-sulfonamide is 7597-04-8.
What is the molecular formula of 4-Amino-N-[3-(trifluoromethyl)phenyl]benzene-1-sulfonamide?
The molecular formula of 4-Amino-N-[3-(trifluoromethyl)phenyl]benzene-1-sulfonamide is C13H11F3N2O2S.
What is the molecular weight of 4-Amino-N-[3-(trifluoromethyl)phenyl]benzene-1-sulfonamide?
The molecular weight of 4-Amino-N-[3-(trifluoromethyl)phenyl]benzene-1-sulfonamide is 316.05 g/mol.
Where can I buy 4-Amino-N-[3-(trifluoromethyl)phenyl]benzene-1-sulfonamide?
You can request a quote for 4-Amino-N-[3-(trifluoromethyl)phenyl]benzene-1-sulfonamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Amino-N-[3-(trifluoromethyl)phenyl]benzene-1-sulfonamide?
Yes, KEHONG BIO provides custom synthesis services for 4-Amino-N-[3-(trifluoromethyl)phenyl]benzene-1-sulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.