6-Methyl-2-[(pyridin-3-ylmethyl)sulfanyl]nicotinonitrile
TL;DR: 6-Methyl-2-[(pyridin-3-ylmethyl)sulfanyl]nicotinonitrile (CAS 625375-69-1) is a chemical compound with molecular formula C13H11N3S and molecular weight 241.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-methyl-2-(pyridin-3-ylmethylsulfanyl)pyridine-3-carbonitrile
Also Known As: 6-methyl-2-[(pyridin-3-ylmethyl)sulfanyl]nicotinonitrile, AM-807/25099002, 6-methyl-2-(3-pyridylmethylthio)pyridine-3-carbonitrile, 6-methyl-2-(pyridin-3-ylmethylsulfanyl)pyridine-3-carbonitrile, F2135-1330
| Molecular Formula | C13H11N3S |
|---|---|
| Molecular Weight | 241.07 g/mol |
| LogP | 2.949 |
| Topological Polar Surface Area | 49.57 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 241.06737 |
| Heavy Atoms | 17 |
| Complexity | 546.3362 |
Chemical Identifiers
| CAS Number | 625375-69-1 |
|---|---|
| SMILES | CC1=NC(=C(C=C1)C#N)SCC2=CN=CC=C2 |
Product Overview
6-Methyl-2-[(pyridin-3-ylmethyl)sulfanyl]nicotinonitrile (CAS 625375-69-1), with molecular formula C13H11N3S and molecular weight 241.07 g/mol. IUPAC: 6-methyl-2-(pyridin-3-ylmethylsulfanyl)pyridine-3-carbonitrile.
Chemical Property Profile of 6-Methyl-2-[(pyridin-3-ylmethyl)sulfanyl]nicotinonitrile
Property Insights of 6-Methyl-2-[(pyridin-3-ylmethyl)sulfanyl]nicotinonitrile
The XLogP value of 2.949 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-Methyl-2-[(pyridin-3-ylmethyl)sulfanyl]nicotinonitrile. With a topological polar surface area (TPSA) of 49.57 Ų, 6-Methyl-2-[(pyridin-3-ylmethyl)sulfanyl]nicotinonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-Methyl-2-[(pyridin-3-ylmethyl)sulfanyl]nicotinonitrile 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 6-Methyl-2-[(pyridin-3-ylmethyl)sulfanyl]nicotinonitrile?
The CAS number of 6-Methyl-2-[(pyridin-3-ylmethyl)sulfanyl]nicotinonitrile is 625375-69-1.
What is the molecular formula of 6-Methyl-2-[(pyridin-3-ylmethyl)sulfanyl]nicotinonitrile?
The molecular formula of 6-Methyl-2-[(pyridin-3-ylmethyl)sulfanyl]nicotinonitrile is C13H11N3S.
What is the molecular weight of 6-Methyl-2-[(pyridin-3-ylmethyl)sulfanyl]nicotinonitrile?
The molecular weight of 6-Methyl-2-[(pyridin-3-ylmethyl)sulfanyl]nicotinonitrile is 241.07 g/mol.
Where can I buy 6-Methyl-2-[(pyridin-3-ylmethyl)sulfanyl]nicotinonitrile?
You can request a quote for 6-Methyl-2-[(pyridin-3-ylmethyl)sulfanyl]nicotinonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-Methyl-2-[(pyridin-3-ylmethyl)sulfanyl]nicotinonitrile?
Yes, KEHONG BIO provides custom synthesis services for 6-Methyl-2-[(pyridin-3-ylmethyl)sulfanyl]nicotinonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.