Benzenemethanesulfonamide
TL;DR: Benzenemethanesulfonamide (CAS 4563-33-1) is a chemical compound with molecular formula C7H9NO2S and molecular weight 171.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
phenylmethanesulfonamide
Also Known As: Phenylmethanesulfonamide, Benzylsulfonamide, Benzenemethanesulfonamide, alpha-Toluenesulfonamide, a-toluenesulfonamide
| Molecular Formula | C7H9NO2S |
|---|---|
| Molecular Weight | 171.04 g/mol |
| LogP | 0.1 |
| Topological Polar Surface Area | 68.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 171.0354 |
| Heavy Atoms | 11 |
| Complexity | 199.0 |
Chemical Identifiers
| CAS Number | 4563-33-1 |
|---|---|
| SMILES | C1=CC=C(C=C1)CS(=O)(=O)N |
| InChIKey | ABOYDMHGKWRPFD-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 22 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Benzenemethanesulfonamide (CAS 4563-33-1), with molecular formula C7H9NO2S and molecular weight 171.04 g/mol. IUPAC: phenylmethanesulfonamide.
Chemical Property Profile of Benzenemethanesulfonamide
Property Insights of Benzenemethanesulfonamide
The XLogP value of 0.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzenemethanesulfonamide. The TPSA of 68.5 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzenemethanesulfonamide. Following Lipinski's Rule of Five, Benzenemethanesulfonamide has 1 hydrogen bond donor(s) and 3 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 Benzenemethanesulfonamide?
The CAS number of Benzenemethanesulfonamide is 4563-33-1.
What is the molecular formula of Benzenemethanesulfonamide?
The molecular formula of Benzenemethanesulfonamide is C7H9NO2S.
What is the molecular weight of Benzenemethanesulfonamide?
The molecular weight of Benzenemethanesulfonamide is 171.04 g/mol.
Where can I buy Benzenemethanesulfonamide?
You can request a quote for Benzenemethanesulfonamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzenemethanesulfonamide?
Yes, KEHONG BIO provides custom synthesis services for Benzenemethanesulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.