2-(4-Chlorobenzenesulphonyl)pyridine-5-carbonitrile
TL;DR: 2-(4-Chlorobenzenesulphonyl)pyridine-5-carbonitrile (CAS 259683-30-2) is a chemical compound with molecular formula C12H7ClN2O2S and molecular weight 277.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-(4-chlorophenyl)sulfonylpyridine-3-carbonitrile
Also Known As: Maybridge3_006424, 2-(4-Chlorobenzenesulphonyl)pyridine-5-carbonitrile, 4-Pyridineacetic acid hydrochloride, 2- PYRIDINE-5-CARBONITRILE, 6-(4-chlorophenyl)sulfonylpyridine-3-carbonitrile
| Molecular Formula | C12H7ClN2O2S |
|---|---|
| Molecular Weight | 277.99 g/mol |
| LogP | 2.43948 |
| Topological Polar Surface Area | 70.82 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 277.99167 |
| Heavy Atoms | 18 |
| Complexity | 701.2378 |
Chemical Identifiers
| CAS Number | 259683-30-2 |
|---|---|
| SMILES | C1=CC(=CC=C1S(=O)(=O)C2=NC=C(C=C2)C#N)Cl |
Product Overview
2-(4-Chlorobenzenesulphonyl)pyridine-5-carbonitrile (CAS 259683-30-2), with molecular formula C12H7ClN2O2S and molecular weight 277.99 g/mol. IUPAC: 6-(4-chlorophenyl)sulfonylpyridine-3-carbonitrile.
Chemical Property Profile of 2-(4-Chlorobenzenesulphonyl)pyridine-5-carbonitrile
Property Insights of 2-(4-Chlorobenzenesulphonyl)pyridine-5-carbonitrile
The XLogP value of 2.43948 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(4-Chlorobenzenesulphonyl)pyridine-5-carbonitrile. The TPSA of 70.82 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(4-Chlorobenzenesulphonyl)pyridine-5-carbonitrile. Following Lipinski's Rule of Five, 2-(4-Chlorobenzenesulphonyl)pyridine-5-carbonitrile has 0 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 2-(4-Chlorobenzenesulphonyl)pyridine-5-carbonitrile?
The CAS number of 2-(4-Chlorobenzenesulphonyl)pyridine-5-carbonitrile is 259683-30-2.
What is the molecular formula of 2-(4-Chlorobenzenesulphonyl)pyridine-5-carbonitrile?
The molecular formula of 2-(4-Chlorobenzenesulphonyl)pyridine-5-carbonitrile is C12H7ClN2O2S.
What is the molecular weight of 2-(4-Chlorobenzenesulphonyl)pyridine-5-carbonitrile?
The molecular weight of 2-(4-Chlorobenzenesulphonyl)pyridine-5-carbonitrile is 277.99 g/mol.
Where can I buy 2-(4-Chlorobenzenesulphonyl)pyridine-5-carbonitrile?
You can request a quote for 2-(4-Chlorobenzenesulphonyl)pyridine-5-carbonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(4-Chlorobenzenesulphonyl)pyridine-5-carbonitrile?
Yes, KEHONG BIO provides custom synthesis services for 2-(4-Chlorobenzenesulphonyl)pyridine-5-carbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.