![3-Pyridyl{[3-(trifluoromethyl)phenyl]sulfonyl}amine structure](/static/products/6120/612042-11-2.webp)
3-Pyridyl{[3-(trifluoromethyl)phenyl]sulfonyl}amine
TL;DR: 3-Pyridyl{[3-(trifluoromethyl)phenyl]sulfonyl}amine (CAS 612042-11-2) is a chemical compound with molecular formula C12H9F3N2O2S and molecular weight 302.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-pyridin-3-yl-3-(trifluoromethyl)benzenesulfonamide
Also Known As: 3-pyridyl{[3-(trifluoromethyl)phenyl]sulfonyl}amine, N-pyridin-3-yl-3-(trifluoromethyl)benzenesulfonamide, [m-(trifluoromethyl)phenylsulfonyl]-3-pyridylamine, AO-854/41286950, N-3-pyridinyl-3-(trifluoromethyl)benzenesulfonamide
| Molecular Formula | C12H9F3N2O2S |
|---|---|
| Molecular Weight | 302.03 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 67.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Exact Mass | 302.0337 |
| Heavy Atoms | 20 |
| Complexity | 419.0 |
Chemical Identifiers
| CAS Number | 612042-11-2 |
|---|---|
| SMILES | C1=CC(=CC(=C1)S(=O)(=O)NC2=CN=CC=C2)C(F)(F)F |
| InChIKey | VRXPIPHFBIPRBF-UHFFFAOYSA-N |
Product Overview
3-Pyridyl{[3-(trifluoromethyl)phenyl]sulfonyl}amine (CAS 612042-11-2), with molecular formula C12H9F3N2O2S and molecular weight 302.03 g/mol. IUPAC: N-pyridin-3-yl-3-(trifluoromethyl)benzenesulfonamide.
Chemical Property Profile of 3-Pyridyl{[3-(trifluoromethyl)phenyl]sulfonyl}amine
Property Insights of 3-Pyridyl{[3-(trifluoromethyl)phenyl]sulfonyl}amine
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Pyridyl{[3-(trifluoromethyl)phenyl]sulfonyl}amine. The TPSA of 67.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Pyridyl{[3-(trifluoromethyl)phenyl]sulfonyl}amine. Following Lipinski's Rule of Five, 3-Pyridyl{[3-(trifluoromethyl)phenyl]sulfonyl}amine has 1 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 3-Pyridyl{[3-(trifluoromethyl)phenyl]sulfonyl}amine?
The CAS number of 3-Pyridyl{[3-(trifluoromethyl)phenyl]sulfonyl}amine is 612042-11-2.
What is the molecular formula of 3-Pyridyl{[3-(trifluoromethyl)phenyl]sulfonyl}amine?
The molecular formula of 3-Pyridyl{[3-(trifluoromethyl)phenyl]sulfonyl}amine is C12H9F3N2O2S.
What is the molecular weight of 3-Pyridyl{[3-(trifluoromethyl)phenyl]sulfonyl}amine?
The molecular weight of 3-Pyridyl{[3-(trifluoromethyl)phenyl]sulfonyl}amine is 302.03 g/mol.
Where can I buy 3-Pyridyl{[3-(trifluoromethyl)phenyl]sulfonyl}amine?
You can request a quote for 3-Pyridyl{[3-(trifluoromethyl)phenyl]sulfonyl}amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Pyridyl{[3-(trifluoromethyl)phenyl]sulfonyl}amine?
Yes, KEHONG BIO provides custom synthesis services for 3-Pyridyl{[3-(trifluoromethyl)phenyl]sulfonyl}amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.