N-(4-cyanophenyl)-4-fluorobenzenesulfonamide
TL;DR: N-(4-cyanophenyl)-4-fluorobenzenesulfonamide (CAS 333442-25-4) is a chemical compound with molecular formula C13H9FN2O2S and molecular weight 276.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4-cyanophenyl)-4-fluorobenzenesulfonamide
Also Known As: N-(4-cyanophenyl)-4-fluorobenzenesulfonamide, UPCMLD0ENAT5709268:001, BAS 01936739, N-(4-Cyano-phenyl)-4-fluoro-benzenesulfonamide, N-(4-cyanophenyl)-4-fluorobenzene-1-sulfonamide
| Molecular Formula | C13H9FN2O2S |
|---|---|
| Molecular Weight | 276.04 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 78.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 276.03687 |
| Heavy Atoms | 19 |
| Complexity | 435.0 |
Chemical Identifiers
| CAS Number | 333442-25-4 |
|---|---|
| SMILES | C1=CC(=CC=C1C#N)NS(=O)(=O)C2=CC=C(C=C2)F |
| InChIKey | DARWVGMHBLSVGJ-UHFFFAOYSA-N |
Product Overview
N-(4-cyanophenyl)-4-fluorobenzenesulfonamide (CAS 333442-25-4), with molecular formula C13H9FN2O2S and molecular weight 276.04 g/mol. IUPAC: N-(4-cyanophenyl)-4-fluorobenzenesulfonamide.
Chemical Property Profile of N-(4-cyanophenyl)-4-fluorobenzenesulfonamide
Property Insights of N-(4-cyanophenyl)-4-fluorobenzenesulfonamide
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(4-cyanophenyl)-4-fluorobenzenesulfonamide. The TPSA of 78.3 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(4-cyanophenyl)-4-fluorobenzenesulfonamide. Following Lipinski's Rule of Five, N-(4-cyanophenyl)-4-fluorobenzenesulfonamide has 1 hydrogen bond donor(s) and 5 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-(4-cyanophenyl)-4-fluorobenzenesulfonamide?
The CAS number of N-(4-cyanophenyl)-4-fluorobenzenesulfonamide is 333442-25-4.
What is the molecular formula of N-(4-cyanophenyl)-4-fluorobenzenesulfonamide?
The molecular formula of N-(4-cyanophenyl)-4-fluorobenzenesulfonamide is C13H9FN2O2S.
What is the molecular weight of N-(4-cyanophenyl)-4-fluorobenzenesulfonamide?
The molecular weight of N-(4-cyanophenyl)-4-fluorobenzenesulfonamide is 276.04 g/mol.
Where can I buy N-(4-cyanophenyl)-4-fluorobenzenesulfonamide?
You can request a quote for N-(4-cyanophenyl)-4-fluorobenzenesulfonamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(4-cyanophenyl)-4-fluorobenzenesulfonamide?
Yes, KEHONG BIO provides custom synthesis services for N-(4-cyanophenyl)-4-fluorobenzenesulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.