对氰基苯磺酰胺
TL;DR: 对氰基苯磺酰胺 (CAS 3119-02-6) is a chemical compound with molecular formula C7H6N2O2S and molecular weight 182.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
对氰基苯磺酰胺
4-cyanobenzenesulfonamide
Also Known As: 4-cyanobenzenesulfonamide, 4-Cyanobenzenesulphonamide, 4-cyanobenzene-1-sulfonamide, p-Cyanobenzenesulfonamide, Benzenesulfonamide, 4-cyano-
| Molecular Formula | C7H6N2O2S |
|---|---|
| Molecular Weight | 182.01 g/mol |
| LogP | 0.2 |
| Topological Polar Surface Area | 92.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 182.015 |
| Heavy Atoms | 12 |
| Complexity | 287.0 |
Chemical Identifiers
| CAS Number | 3119-02-6 |
|---|---|
| SMILES | C1=CC(=CC=C1C#N)S(=O)(=O)N |
| InChIKey | UZECCNDOASGYNH-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 9 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
对氰基苯磺酰胺 (CAS 3119-02-6), with molecular formula C7H6N2O2S and molecular weight 182.01 g/mol. IUPAC: 4-cyanobenzenesulfonamide.
Chemical Property Profile of 对氰基苯磺酰胺
Property Insights of 对氰基苯磺酰胺
The XLogP value of 0.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 对氰基苯磺酰胺. The TPSA of 92.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 对氰基苯磺酰胺. Following Lipinski's Rule of Five, 对氰基苯磺酰胺 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 对氰基苯磺酰胺?
The CAS number of 对氰基苯磺酰胺 is 3119-02-6.
What is the molecular formula of 对氰基苯磺酰胺?
The molecular formula of 对氰基苯磺酰胺 is C7H6N2O2S.
What is the molecular weight of 对氰基苯磺酰胺?
The molecular weight of 对氰基苯磺酰胺 is 182.01 g/mol.
Where can I buy 对氰基苯磺酰胺?
You can request a quote for 对氰基苯磺酰胺 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 对氰基苯磺酰胺?
Yes, KEHONG BIO provides custom synthesis services for 对氰基苯磺酰胺 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.