![5-Acetyl-2-[(4-chlorophenyl)sulfanyl]-6-methylnicotinonitrile structure](/static/products/3031/303146-64-7.webp)
5-Acetyl-2-[(4-chlorophenyl)sulfanyl]-6-methylnicotinonitrile
TL;DR: 5-Acetyl-2-[(4-chlorophenyl)sulfanyl]-6-methylnicotinonitrile (CAS 303146-64-7) is a chemical compound with molecular formula C15H11ClN2OS and molecular weight 302.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-acetyl-2-(4-chlorophenyl)sulfanyl-6-methylpyridine-3-carbonitrile
Also Known As: 5-acetyl-2-[(4-chlorophenyl)sulfanyl]-6-methylnicotinonitrile, 11K-369S, 5-acetyl-2-[(4-chlorophenyl)sulfanyl]-6-methylpyridine-3-carbonitrile, 5-acetyl-2-(4-chlorophenyl)sulfanyl-6-methylpyridine-3-carbonitrile, 5-Acetyl-2-[(4-chlorophenyl)thio]-6-methyl-3-pyridinecarbonitrile
| Molecular Formula | C15H11ClN2OS |
|---|---|
| Molecular Weight | 302.03 g/mol |
| LogP | 4.2689 |
| Topological Polar Surface Area | 53.75 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 302.02808 |
| Heavy Atoms | 20 |
| Complexity | 705.0488 |
Chemical Identifiers
| CAS Number | 303146-64-7 |
|---|---|
| SMILES | CC1=C(C=C(C(=N1)SC2=CC=C(C=C2)Cl)C#N)C(=O)C |
Product Overview
5-Acetyl-2-[(4-chlorophenyl)sulfanyl]-6-methylnicotinonitrile (CAS 303146-64-7), with molecular formula C15H11ClN2OS and molecular weight 302.03 g/mol. IUPAC: 5-acetyl-2-(4-chlorophenyl)sulfanyl-6-methylpyridine-3-carbonitrile.
Chemical Property Profile of 5-Acetyl-2-[(4-chlorophenyl)sulfanyl]-6-methylnicotinonitrile
Property Insights of 5-Acetyl-2-[(4-chlorophenyl)sulfanyl]-6-methylnicotinonitrile
The XLogP value of 4.2689 indicates that 5-Acetyl-2-[(4-chlorophenyl)sulfanyl]-6-methylnicotinonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 53.75 Ų, 5-Acetyl-2-[(4-chlorophenyl)sulfanyl]-6-methylnicotinonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Acetyl-2-[(4-chlorophenyl)sulfanyl]-6-methylnicotinonitrile 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 5-Acetyl-2-[(4-chlorophenyl)sulfanyl]-6-methylnicotinonitrile?
The CAS number of 5-Acetyl-2-[(4-chlorophenyl)sulfanyl]-6-methylnicotinonitrile is 303146-64-7.
What is the molecular formula of 5-Acetyl-2-[(4-chlorophenyl)sulfanyl]-6-methylnicotinonitrile?
The molecular formula of 5-Acetyl-2-[(4-chlorophenyl)sulfanyl]-6-methylnicotinonitrile is C15H11ClN2OS.
What is the molecular weight of 5-Acetyl-2-[(4-chlorophenyl)sulfanyl]-6-methylnicotinonitrile?
The molecular weight of 5-Acetyl-2-[(4-chlorophenyl)sulfanyl]-6-methylnicotinonitrile is 302.03 g/mol.
Where can I buy 5-Acetyl-2-[(4-chlorophenyl)sulfanyl]-6-methylnicotinonitrile?
You can request a quote for 5-Acetyl-2-[(4-chlorophenyl)sulfanyl]-6-methylnicotinonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Acetyl-2-[(4-chlorophenyl)sulfanyl]-6-methylnicotinonitrile?
Yes, KEHONG BIO provides custom synthesis services for 5-Acetyl-2-[(4-chlorophenyl)sulfanyl]-6-methylnicotinonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.