![2-[(4-Chlorophenyl)sulfonyl]-4-methoxynicotinonitrile structure](/static/products/3384/338411-91-9.webp)
2-[(4-Chlorophenyl)sulfonyl]-4-methoxynicotinonitrile
TL;DR: 2-[(4-Chlorophenyl)sulfonyl]-4-methoxynicotinonitrile (CAS 338411-91-9) is a chemical compound with molecular formula C13H9ClN2O3S and molecular weight 308.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-chlorophenyl)sulfonyl-4-methoxypyridine-3-carbonitrile
Also Known As: 2-[(4-chlorophenyl)sulfonyl]-4-methoxynicotinonitrile, 2-(4-chlorophenyl)sulfonyl-4-methoxypyridine-3-carbonitrile, 3K-056, 2-(4-chlorobenzenesulfonyl)-4-methoxypyridine-3-carbonitrile
| Molecular Formula | C13H9ClN2O3S |
|---|---|
| Molecular Weight | 308.00 g/mol |
| LogP | 2.44808 |
| Topological Polar Surface Area | 80.05 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 308.00223 |
| Heavy Atoms | 20 |
| Complexity | 780.25385 |
Chemical Identifiers
| CAS Number | 338411-91-9 |
|---|---|
| SMILES | COC1=C(C(=NC=C1)S(=O)(=O)C2=CC=C(C=C2)Cl)C#N |
Product Overview
2-[(4-Chlorophenyl)sulfonyl]-4-methoxynicotinonitrile (CAS 338411-91-9), with molecular formula C13H9ClN2O3S and molecular weight 308.00 g/mol. IUPAC: 2-(4-chlorophenyl)sulfonyl-4-methoxypyridine-3-carbonitrile.
Chemical Property Profile of 2-[(4-Chlorophenyl)sulfonyl]-4-methoxynicotinonitrile
Property Insights of 2-[(4-Chlorophenyl)sulfonyl]-4-methoxynicotinonitrile
The XLogP value of 2.44808 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[(4-Chlorophenyl)sulfonyl]-4-methoxynicotinonitrile. The TPSA of 80.05 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[(4-Chlorophenyl)sulfonyl]-4-methoxynicotinonitrile. Following Lipinski's Rule of Five, 2-[(4-Chlorophenyl)sulfonyl]-4-methoxynicotinonitrile has 0 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 2-[(4-Chlorophenyl)sulfonyl]-4-methoxynicotinonitrile?
The CAS number of 2-[(4-Chlorophenyl)sulfonyl]-4-methoxynicotinonitrile is 338411-91-9.
What is the molecular formula of 2-[(4-Chlorophenyl)sulfonyl]-4-methoxynicotinonitrile?
The molecular formula of 2-[(4-Chlorophenyl)sulfonyl]-4-methoxynicotinonitrile is C13H9ClN2O3S.
What is the molecular weight of 2-[(4-Chlorophenyl)sulfonyl]-4-methoxynicotinonitrile?
The molecular weight of 2-[(4-Chlorophenyl)sulfonyl]-4-methoxynicotinonitrile is 308.00 g/mol.
Where can I buy 2-[(4-Chlorophenyl)sulfonyl]-4-methoxynicotinonitrile?
You can request a quote for 2-[(4-Chlorophenyl)sulfonyl]-4-methoxynicotinonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[(4-Chlorophenyl)sulfonyl]-4-methoxynicotinonitrile?
Yes, KEHONG BIO provides custom synthesis services for 2-[(4-Chlorophenyl)sulfonyl]-4-methoxynicotinonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.