![5-{2-[(5-acetyl-3-cyano-6-methylpyridin-2-yl)sulfanyl]acetyl}-6-methyl-2-(methylsulfanyl)pyridine-3-carbonitrile structure](/static/products/3299/329908-82-9.webp)
5-{2-[(5-acetyl-3-cyano-6-methylpyridin-2-yl)sulfanyl]acetyl}-6-methyl-2-(methylsulfanyl)pyridine-3-carbonitrile
TL;DR: 5-{2-[(5-acetyl-3-cyano-6-methylpyridin-2-yl)sulfanyl]acetyl}-6-methyl-2-(methylsulfanyl)pyridine-3-carbonitrile (CAS 329908-82-9) is a chemical compound with molecular formula C19H16N4O2S2 and molecular weight 396.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-acetyl-2-[2-(5-cyano-2-methyl-6-methylsulfanyl-3-pyridinyl)-2-oxoethyl]sulfanyl-6-methylpyridine-3-carbonitrile
Also Known As: 5-{2-[(5-acetyl-3-cyano-6-methylpyridin-2-yl)sulfanyl]acetyl}-6-methyl-2-(methylsulfanyl)pyridine-3-carbonitrile, 5-acetyl-2-[2-(5-cyano-2-methyl-6-methylsulfanylpyridin-3-yl)-2-oxoethyl]sulfanyl-6-methylpyridine-3-carbonitrile
| Molecular Formula | C19H16N4O2S2 |
|---|---|
| Molecular Weight | 396.07 g/mol |
| LogP | 3.7363 |
| Topological Polar Surface Area | 107.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 6 |
| Exact Mass | 396.07147 |
| Heavy Atoms | 27 |
| Complexity | 1019.8356 |
Chemical Identifiers
| CAS Number | 329908-82-9 |
|---|---|
| SMILES | CC1=C(C=C(C(=N1)SCC(=O)C2=C(N=C(C(=C2)C#N)SC)C)C#N)C(=O)C |
Product Overview
5-{2-[(5-acetyl-3-cyano-6-methylpyridin-2-yl)sulfanyl]acetyl}-6-methyl-2-(methylsulfanyl)pyridine-3-carbonitrile (CAS 329908-82-9), with molecular formula C19H16N4O2S2 and molecular weight 396.07 g/mol. IUPAC: 5-acetyl-2-[2-(5-cyano-2-methyl-6-methylsulfanyl-3-pyridinyl)-2-oxoethyl]sulfanyl-6-methylpyridine-3-carbonitrile.
Chemical Property Profile of 5-{2-[(5-acetyl-3-cyano-6-methylpyridin-2-yl)sulfanyl]acetyl}-6-methyl-2-(methylsulfanyl)pyridine-3-carbonitrile
Property Insights of 5-{2-[(5-acetyl-3-cyano-6-methylpyridin-2-yl)sulfanyl]acetyl}-6-methyl-2-(methylsulfanyl)pyridine-3-carbonitrile
The XLogP value of 3.7363 indicates that 5-{2-[(5-acetyl-3-cyano-6-methylpyridin-2-yl)sulfanyl]acetyl}-6-methyl-2-(methylsulfanyl)pyridine-3-carbonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 107.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-{2-[(5-acetyl-3-cyano-6-methylpyridin-2-yl)sulfanyl]acetyl}-6-methyl-2-(methylsulfanyl)pyridine-3-carbonitrile. Following Lipinski's Rule of Five, 5-{2-[(5-acetyl-3-cyano-6-methylpyridin-2-yl)sulfanyl]acetyl}-6-methyl-2-(methylsulfanyl)pyridine-3-carbonitrile has 0 hydrogen bond donor(s) and 8 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-{2-[(5-acetyl-3-cyano-6-methylpyridin-2-yl)sulfanyl]acetyl}-6-methyl-2-(methylsulfanyl)pyridine-3-carbonitrile?
The CAS number of 5-{2-[(5-acetyl-3-cyano-6-methylpyridin-2-yl)sulfanyl]acetyl}-6-methyl-2-(methylsulfanyl)pyridine-3-carbonitrile is 329908-82-9.
What is the molecular formula of 5-{2-[(5-acetyl-3-cyano-6-methylpyridin-2-yl)sulfanyl]acetyl}-6-methyl-2-(methylsulfanyl)pyridine-3-carbonitrile?
The molecular formula of 5-{2-[(5-acetyl-3-cyano-6-methylpyridin-2-yl)sulfanyl]acetyl}-6-methyl-2-(methylsulfanyl)pyridine-3-carbonitrile is C19H16N4O2S2.
What is the molecular weight of 5-{2-[(5-acetyl-3-cyano-6-methylpyridin-2-yl)sulfanyl]acetyl}-6-methyl-2-(methylsulfanyl)pyridine-3-carbonitrile?
The molecular weight of 5-{2-[(5-acetyl-3-cyano-6-methylpyridin-2-yl)sulfanyl]acetyl}-6-methyl-2-(methylsulfanyl)pyridine-3-carbonitrile is 396.07 g/mol.
Where can I buy 5-{2-[(5-acetyl-3-cyano-6-methylpyridin-2-yl)sulfanyl]acetyl}-6-methyl-2-(methylsulfanyl)pyridine-3-carbonitrile?
You can request a quote for 5-{2-[(5-acetyl-3-cyano-6-methylpyridin-2-yl)sulfanyl]acetyl}-6-methyl-2-(methylsulfanyl)pyridine-3-carbonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-{2-[(5-acetyl-3-cyano-6-methylpyridin-2-yl)sulfanyl]acetyl}-6-methyl-2-(methylsulfanyl)pyridine-3-carbonitrile?
Yes, KEHONG BIO provides custom synthesis services for 5-{2-[(5-acetyl-3-cyano-6-methylpyridin-2-yl)sulfanyl]acetyl}-6-methyl-2-(methylsulfanyl)pyridine-3-carbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.