N-benzyl-3-(trifluoromethyl)benzene-1-sulfonamide
TL;DR: N-benzyl-3-(trifluoromethyl)benzene-1-sulfonamide (CAS 613657-89-9) is a chemical compound with molecular formula C14H12F3NO2S and molecular weight 315.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-benzyl-3-(trifluoromethyl)benzenesulfonamide
Also Known As: N-benzyl-3-(trifluoromethyl)benzene-1-sulfonamide, N-benzyl-3-(trifluoromethyl)benzenesulfonamide, N-(Phenylmethyl)-3-(trifluoromethyl)benzenesulfonamide
| Molecular Formula | C14H12F3NO2S |
|---|---|
| Molecular Weight | 315.05 g/mol |
| LogP | 3.1839 |
| Topological Polar Surface Area | 46.17 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 315.05408 |
| Heavy Atoms | 21 |
| Complexity | 712.499 |
Chemical Identifiers
| CAS Number | 613657-89-9 |
|---|---|
| SMILES | C1=CC=C(C=C1)CNS(=O)(=O)C2=CC=CC(=C2)C(F)(F)F |
Product Overview
N-benzyl-3-(trifluoromethyl)benzene-1-sulfonamide (CAS 613657-89-9), with molecular formula C14H12F3NO2S and molecular weight 315.05 g/mol. IUPAC: N-benzyl-3-(trifluoromethyl)benzenesulfonamide.
Chemical Property Profile of N-benzyl-3-(trifluoromethyl)benzene-1-sulfonamide
Property Insights of N-benzyl-3-(trifluoromethyl)benzene-1-sulfonamide
The XLogP value of 3.1839 indicates that N-benzyl-3-(trifluoromethyl)benzene-1-sulfonamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.17 Ų, N-benzyl-3-(trifluoromethyl)benzene-1-sulfonamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-benzyl-3-(trifluoromethyl)benzene-1-sulfonamide has 1 hydrogen bond donor(s) and 2 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 N-benzyl-3-(trifluoromethyl)benzene-1-sulfonamide?
The CAS number of N-benzyl-3-(trifluoromethyl)benzene-1-sulfonamide is 613657-89-9.
What is the molecular formula of N-benzyl-3-(trifluoromethyl)benzene-1-sulfonamide?
The molecular formula of N-benzyl-3-(trifluoromethyl)benzene-1-sulfonamide is C14H12F3NO2S.
What is the molecular weight of N-benzyl-3-(trifluoromethyl)benzene-1-sulfonamide?
The molecular weight of N-benzyl-3-(trifluoromethyl)benzene-1-sulfonamide is 315.05 g/mol.
Where can I buy N-benzyl-3-(trifluoromethyl)benzene-1-sulfonamide?
You can request a quote for N-benzyl-3-(trifluoromethyl)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 N-benzyl-3-(trifluoromethyl)benzene-1-sulfonamide?
Yes, KEHONG BIO provides custom synthesis services for N-benzyl-3-(trifluoromethyl)benzene-1-sulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.