![4-cyano-N-[2-(hydroxymethyl)phenyl]benzenesulfonamide structure](/static/products/853/853689-16-4.png)
4-cyano-N-[2-(hydroxymethyl)phenyl]benzenesulfonamide
TL;DR: 4-cyano-N-[2-(hydroxymethyl)phenyl]benzenesulfonamide (CAS 853689-16-4) is a chemical compound with molecular formula C14H12N2O3S and molecular weight 288.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-cyano-N-[2-(hydroxymethyl)phenyl]benzenesulfonamide
Also Known As: 4-cyano-N-[2-(hydroxymethyl)phenyl]benzenesulfonamide, AO-854/43450543
| Molecular Formula | C14H12N2O3S |
|---|---|
| Molecular Weight | 288.06 g/mol |
| LogP | 1.85138 |
| Topological Polar Surface Area | 90.19 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 288.05685 |
| Heavy Atoms | 20 |
| Complexity | 746.73364 |
Chemical Identifiers
| CAS Number | 853689-16-4 |
|---|---|
| SMILES | C1=CC=C(C(=C1)CO)NS(=O)(=O)C2=CC=C(C=C2)C#N |
Product Overview
4-cyano-N-[2-(hydroxymethyl)phenyl]benzenesulfonamide (CAS 853689-16-4), with molecular formula C14H12N2O3S and molecular weight 288.06 g/mol. IUPAC: 4-cyano-N-[2-(hydroxymethyl)phenyl]benzenesulfonamide.
Chemical Property Profile of 4-cyano-N-[2-(hydroxymethyl)phenyl]benzenesulfonamide
Property Insights of 4-cyano-N-[2-(hydroxymethyl)phenyl]benzenesulfonamide
The XLogP value of 1.85138 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-cyano-N-[2-(hydroxymethyl)phenyl]benzenesulfonamide. The TPSA of 90.19 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-cyano-N-[2-(hydroxymethyl)phenyl]benzenesulfonamide. Following Lipinski's Rule of Five, 4-cyano-N-[2-(hydroxymethyl)phenyl]benzenesulfonamide has 2 hydrogen bond donor(s) and 4 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-cyano-N-[2-(hydroxymethyl)phenyl]benzenesulfonamide?
The CAS number of 4-cyano-N-[2-(hydroxymethyl)phenyl]benzenesulfonamide is 853689-16-4.
What is the molecular formula of 4-cyano-N-[2-(hydroxymethyl)phenyl]benzenesulfonamide?
The molecular formula of 4-cyano-N-[2-(hydroxymethyl)phenyl]benzenesulfonamide is C14H12N2O3S.
What is the molecular weight of 4-cyano-N-[2-(hydroxymethyl)phenyl]benzenesulfonamide?
The molecular weight of 4-cyano-N-[2-(hydroxymethyl)phenyl]benzenesulfonamide is 288.06 g/mol.
Where can I buy 4-cyano-N-[2-(hydroxymethyl)phenyl]benzenesulfonamide?
You can request a quote for 4-cyano-N-[2-(hydroxymethyl)phenyl]benzenesulfonamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-cyano-N-[2-(hydroxymethyl)phenyl]benzenesulfonamide?
Yes, KEHONG BIO provides custom synthesis services for 4-cyano-N-[2-(hydroxymethyl)phenyl]benzenesulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.