6-Amino-5-[(4-chlorophenyl)sulfonyl]-2-hydroxynicotinonitrile
TL;DR: 6-Amino-5-[(4-chlorophenyl)sulfonyl]-2-hydroxynicotinonitrile (CAS 338774-48-4) is a chemical compound with molecular formula C12H8ClN3O3S and molecular weight 309.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-amino-5-(4-chlorophenyl)sulfonyl-2-oxo-1H-pyridine-3-carbonitrile
Also Known As: 6-amino-5-[(4-chlorophenyl)sulfonyl]-2-hydroxynicotinonitrile, 6-amino-5-(4-chlorophenyl)sulfonyl-2-oxo-1H-pyridine-3-carbonitrile, 6-amino-5-(4-chlorobenzenesulfonyl)-2-hydroxypyridine-3-carbonitrile, 6-Amino-5-((4-chlorophenyl)sulfonyl)-2-hydroxynicotinonitrile, 6-Amino-5-(4-chlorophenyl)sulfonyl-2-hydroxynicotinonitrile
| Molecular Formula | C12H8ClN3O3S |
|---|---|
| Molecular Weight | 309.00 g/mol |
| LogP | 1.31498 |
| Topological Polar Surface Area | 116.81 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 308.9975 |
| Heavy Atoms | 20 |
| Complexity | 864.301 |
Chemical Identifiers
| CAS Number | 338774-48-4 |
|---|---|
| SMILES | C1=CC(=CC=C1S(=O)(=O)C2=C(NC(=O)C(=C2)C#N)N)Cl |
Product Overview
6-Amino-5-[(4-chlorophenyl)sulfonyl]-2-hydroxynicotinonitrile (CAS 338774-48-4), with molecular formula C12H8ClN3O3S and molecular weight 309.00 g/mol. IUPAC: 6-amino-5-(4-chlorophenyl)sulfonyl-2-oxo-1H-pyridine-3-carbonitrile.
Chemical Property Profile of 6-Amino-5-[(4-chlorophenyl)sulfonyl]-2-hydroxynicotinonitrile
Property Insights of 6-Amino-5-[(4-chlorophenyl)sulfonyl]-2-hydroxynicotinonitrile
The XLogP value of 1.31498 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-Amino-5-[(4-chlorophenyl)sulfonyl]-2-hydroxynicotinonitrile. The TPSA of 116.81 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-Amino-5-[(4-chlorophenyl)sulfonyl]-2-hydroxynicotinonitrile. Following Lipinski's Rule of Five, 6-Amino-5-[(4-chlorophenyl)sulfonyl]-2-hydroxynicotinonitrile has 2 hydrogen bond donor(s) and 5 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 6-Amino-5-[(4-chlorophenyl)sulfonyl]-2-hydroxynicotinonitrile?
The CAS number of 6-Amino-5-[(4-chlorophenyl)sulfonyl]-2-hydroxynicotinonitrile is 338774-48-4.
What is the molecular formula of 6-Amino-5-[(4-chlorophenyl)sulfonyl]-2-hydroxynicotinonitrile?
The molecular formula of 6-Amino-5-[(4-chlorophenyl)sulfonyl]-2-hydroxynicotinonitrile is C12H8ClN3O3S.
What is the molecular weight of 6-Amino-5-[(4-chlorophenyl)sulfonyl]-2-hydroxynicotinonitrile?
The molecular weight of 6-Amino-5-[(4-chlorophenyl)sulfonyl]-2-hydroxynicotinonitrile is 309.00 g/mol.
Where can I buy 6-Amino-5-[(4-chlorophenyl)sulfonyl]-2-hydroxynicotinonitrile?
You can request a quote for 6-Amino-5-[(4-chlorophenyl)sulfonyl]-2-hydroxynicotinonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-Amino-5-[(4-chlorophenyl)sulfonyl]-2-hydroxynicotinonitrile?
Yes, KEHONG BIO provides custom synthesis services for 6-Amino-5-[(4-chlorophenyl)sulfonyl]-2-hydroxynicotinonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.