4-((4-Aminophenyl)sulfonyl)-3-(trifluoromethyl)benzenamine
TL;DR: 4-((4-Aminophenyl)sulfonyl)-3-(trifluoromethyl)benzenamine (CAS 2822-52-8) 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-(4-aminophenyl)sulfonyl-3-(trifluoromethyl)aniline
Also Known As: 4,4'-Diamino-2-trifluoromethyl diphenyl sulfone, 4-[(4-Aminophenyl)sulfonyl]-3-(trifluoromethyl)benzenamine, 4-(4-aminobenzenesulfonyl)-3-(trifluoromethyl)aniline, 4-(4-aminophenyl)sulfonyl-3-(trifluoromethyl)aniline, 3-(Trifluoromethyl)-4-[(4-aminophenyl)sulfonyl]aniline
| Molecular Formula | C13H11F3N2O2S |
|---|---|
| Molecular Weight | 316.05 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 94.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 2 |
| Exact Mass | 316.04935 |
| Heavy Atoms | 21 |
| Complexity | 453.0 |
Chemical Identifiers
| CAS Number | 2822-52-8 |
|---|---|
| SMILES | C1=CC(=CC=C1N)S(=O)(=O)C2=C(C=C(C=C2)N)C(F)(F)F |
| InChIKey | ZENQLKMTWBISFT-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-((4-Aminophenyl)sulfonyl)-3-(trifluoromethyl)benzenamine (CAS 2822-52-8), with molecular formula C13H11F3N2O2S and molecular weight 316.05 g/mol. IUPAC: 4-(4-aminophenyl)sulfonyl-3-(trifluoromethyl)aniline.
Chemical Property Profile of 4-((4-Aminophenyl)sulfonyl)-3-(trifluoromethyl)benzenamine
Property Insights of 4-((4-Aminophenyl)sulfonyl)-3-(trifluoromethyl)benzenamine
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-((4-Aminophenyl)sulfonyl)-3-(trifluoromethyl)benzenamine. The TPSA of 94.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-((4-Aminophenyl)sulfonyl)-3-(trifluoromethyl)benzenamine. Following Lipinski's Rule of Five, 4-((4-Aminophenyl)sulfonyl)-3-(trifluoromethyl)benzenamine 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-((4-Aminophenyl)sulfonyl)-3-(trifluoromethyl)benzenamine?
The CAS number of 4-((4-Aminophenyl)sulfonyl)-3-(trifluoromethyl)benzenamine is 2822-52-8.
What is the molecular formula of 4-((4-Aminophenyl)sulfonyl)-3-(trifluoromethyl)benzenamine?
The molecular formula of 4-((4-Aminophenyl)sulfonyl)-3-(trifluoromethyl)benzenamine is C13H11F3N2O2S.
What is the molecular weight of 4-((4-Aminophenyl)sulfonyl)-3-(trifluoromethyl)benzenamine?
The molecular weight of 4-((4-Aminophenyl)sulfonyl)-3-(trifluoromethyl)benzenamine is 316.05 g/mol.
Where can I buy 4-((4-Aminophenyl)sulfonyl)-3-(trifluoromethyl)benzenamine?
You can request a quote for 4-((4-Aminophenyl)sulfonyl)-3-(trifluoromethyl)benzenamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-((4-Aminophenyl)sulfonyl)-3-(trifluoromethyl)benzenamine?
Yes, KEHONG BIO provides custom synthesis services for 4-((4-Aminophenyl)sulfonyl)-3-(trifluoromethyl)benzenamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.