2-((2,5-dioxo-1-phenylpyrrolidin-3-yl)thio)-4-(methoxymethyl)-6-methylnicotinonitrile
TL;DR: 2-((2,5-dioxo-1-phenylpyrrolidin-3-yl)thio)-4-(methoxymethyl)-6-methylnicotinonitrile (CAS 896656-40-9) is a chemical compound with molecular formula C19H17N3O3S and molecular weight 367.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2,5-dioxo-1-phenylpyrrolidin-3-yl)sulfanyl-4-(methoxymethyl)-6-methylpyridine-3-carbonitrile
Also Known As: 2-((2,5-dioxo-1-phenylpyrrolidin-3-yl)thio)-4-(methoxymethyl)-6-methylnicotinonitrile, 2-(2,5-dioxo-1-phenylpyrrolidin-3-yl)sulfanyl-4-(methoxymethyl)-6-methylpyridine-3-carbonitrile, 2-[(2,5-dioxo-1-phenylpyrrolidin-3-yl)sulfanyl]-4-(methoxymethyl)-6-methylpyridine-3-carbonitrile, 2-(2,5-dioxo-1-phenyl-pyrrolidin-3-yl)sulfanyl-4-(methoxymethyl)-6-methyl-pyridine-3-carbonitrile
| Molecular Formula | C19H17N3O3S |
|---|---|
| Molecular Weight | 367.10 g/mol |
| LogP | 2.8323 |
| Topological Polar Surface Area | 83.29 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 367.09906 |
| Heavy Atoms | 26 |
| Complexity | 892.89264 |
Chemical Identifiers
| CAS Number | 896656-40-9 |
|---|---|
| SMILES | CC1=CC(=C(C(=N1)SC2CC(=O)N(C2=O)C3=CC=CC=C3)C#N)COC |
Product Overview
2-((2,5-dioxo-1-phenylpyrrolidin-3-yl)thio)-4-(methoxymethyl)-6-methylnicotinonitrile (CAS 896656-40-9), with molecular formula C19H17N3O3S and molecular weight 367.10 g/mol. IUPAC: 2-(2,5-dioxo-1-phenylpyrrolidin-3-yl)sulfanyl-4-(methoxymethyl)-6-methylpyridine-3-carbonitrile.
Chemical Property Profile of 2-((2,5-dioxo-1-phenylpyrrolidin-3-yl)thio)-4-(methoxymethyl)-6-methylnicotinonitrile
Property Insights of 2-((2,5-dioxo-1-phenylpyrrolidin-3-yl)thio)-4-(methoxymethyl)-6-methylnicotinonitrile
The XLogP value of 2.8323 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-((2,5-dioxo-1-phenylpyrrolidin-3-yl)thio)-4-(methoxymethyl)-6-methylnicotinonitrile. The TPSA of 83.29 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-((2,5-dioxo-1-phenylpyrrolidin-3-yl)thio)-4-(methoxymethyl)-6-methylnicotinonitrile. Following Lipinski's Rule of Five, 2-((2,5-dioxo-1-phenylpyrrolidin-3-yl)thio)-4-(methoxymethyl)-6-methylnicotinonitrile has 0 hydrogen bond donor(s) and 6 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-((2,5-dioxo-1-phenylpyrrolidin-3-yl)thio)-4-(methoxymethyl)-6-methylnicotinonitrile?
The CAS number of 2-((2,5-dioxo-1-phenylpyrrolidin-3-yl)thio)-4-(methoxymethyl)-6-methylnicotinonitrile is 896656-40-9.
What is the molecular formula of 2-((2,5-dioxo-1-phenylpyrrolidin-3-yl)thio)-4-(methoxymethyl)-6-methylnicotinonitrile?
The molecular formula of 2-((2,5-dioxo-1-phenylpyrrolidin-3-yl)thio)-4-(methoxymethyl)-6-methylnicotinonitrile is C19H17N3O3S.
What is the molecular weight of 2-((2,5-dioxo-1-phenylpyrrolidin-3-yl)thio)-4-(methoxymethyl)-6-methylnicotinonitrile?
The molecular weight of 2-((2,5-dioxo-1-phenylpyrrolidin-3-yl)thio)-4-(methoxymethyl)-6-methylnicotinonitrile is 367.10 g/mol.
Where can I buy 2-((2,5-dioxo-1-phenylpyrrolidin-3-yl)thio)-4-(methoxymethyl)-6-methylnicotinonitrile?
You can request a quote for 2-((2,5-dioxo-1-phenylpyrrolidin-3-yl)thio)-4-(methoxymethyl)-6-methylnicotinonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-((2,5-dioxo-1-phenylpyrrolidin-3-yl)thio)-4-(methoxymethyl)-6-methylnicotinonitrile?
Yes, KEHONG BIO provides custom synthesis services for 2-((2,5-dioxo-1-phenylpyrrolidin-3-yl)thio)-4-(methoxymethyl)-6-methylnicotinonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.