3-cyano-N-(3-methoxyphenyl)benzenesulfonamide
TL;DR: 3-cyano-N-(3-methoxyphenyl)benzenesulfonamide (CAS 1004033-45-7) 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.
3-cyano-N-(3-methoxyphenyl)benzenesulfonamide
Also Known As: 3-cyano-N-(3-methoxyphenyl)benzenesulfonamide
| Molecular Formula | C14H12N2O3S |
|---|---|
| Molecular Weight | 288.06 g/mol |
| LogP | 2.36768 |
| Topological Polar Surface Area | 79.19 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 288.05685 |
| Heavy Atoms | 20 |
| Complexity | 763.98364 |
Chemical Identifiers
| CAS Number | 1004033-45-7 |
|---|---|
| SMILES | COC1=CC=CC(=C1)NS(=O)(=O)C2=CC=CC(=C2)C#N |
Product Overview
3-cyano-N-(3-methoxyphenyl)benzenesulfonamide (CAS 1004033-45-7), with molecular formula C14H12N2O3S and molecular weight 288.06 g/mol. IUPAC: 3-cyano-N-(3-methoxyphenyl)benzenesulfonamide.
Chemical Property Profile of 3-cyano-N-(3-methoxyphenyl)benzenesulfonamide
Property Insights of 3-cyano-N-(3-methoxyphenyl)benzenesulfonamide
The XLogP value of 2.36768 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-cyano-N-(3-methoxyphenyl)benzenesulfonamide. The TPSA of 79.19 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-cyano-N-(3-methoxyphenyl)benzenesulfonamide. Following Lipinski's Rule of Five, 3-cyano-N-(3-methoxyphenyl)benzenesulfonamide has 1 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 3-cyano-N-(3-methoxyphenyl)benzenesulfonamide?
The CAS number of 3-cyano-N-(3-methoxyphenyl)benzenesulfonamide is 1004033-45-7.
What is the molecular formula of 3-cyano-N-(3-methoxyphenyl)benzenesulfonamide?
The molecular formula of 3-cyano-N-(3-methoxyphenyl)benzenesulfonamide is C14H12N2O3S.
What is the molecular weight of 3-cyano-N-(3-methoxyphenyl)benzenesulfonamide?
The molecular weight of 3-cyano-N-(3-methoxyphenyl)benzenesulfonamide is 288.06 g/mol.
Where can I buy 3-cyano-N-(3-methoxyphenyl)benzenesulfonamide?
You can request a quote for 3-cyano-N-(3-methoxyphenyl)benzenesulfonamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-cyano-N-(3-methoxyphenyl)benzenesulfonamide?
Yes, KEHONG BIO provides custom synthesis services for 3-cyano-N-(3-methoxyphenyl)benzenesulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.