2-(4-Methylquinolin-2-yl)sulfanylacetonitrile
TL;DR: 2-(4-Methylquinolin-2-yl)sulfanylacetonitrile (CAS 7521-23-5) is a chemical compound with molecular formula C12H10N2S and molecular weight 214.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-methylquinolin-2-yl)sulfanylacetonitrile
Also Known As: [(4-methylquinolin-2-yl)thio]acetonitrile|2-(4-methylquinolin-2-yl)sulfanylacetonitrile|2-((4-methylquinolin-2-yl)thio)acetonitrile|Acetonitrile, 2-[(4-methyl-2-quinolinyl)thio]-|[(4-methyl-2-quinolinyl)thio]acetonitrile|[(4-methyl-2-quinolinyl)sulfanyl]acetonitrile|[(4-methylquinolin-2-yl)sulfanyl]acetonitrile|AF-399/11297118|SR-01000288297-1|2-[(4-METHYLQUINOLIN-2-YL)SULFANYL]ACETONITRILE|F1143-1800
| Molecular Formula | C12H10N2S |
|---|---|
| Molecular Weight | 214.06 g/mol |
| LogP | 3.1589 |
| Topological Polar Surface Area | 36.68 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 214.05647 |
| Heavy Atoms | 15 |
| Complexity | 528.6234 |
Chemical Identifiers
| CAS Number | 7521-23-5 |
|---|---|
| SMILES | CC1=CC(=NC2=CC=CC=C12)SCC#N |
Product Overview
2-(4-Methylquinolin-2-yl)sulfanylacetonitrile (CAS 7521-23-5), with molecular formula C12H10N2S and molecular weight 214.06 g/mol. IUPAC: 2-(4-methylquinolin-2-yl)sulfanylacetonitrile.
Chemical Property Profile of 2-(4-Methylquinolin-2-yl)sulfanylacetonitrile
Property Insights of 2-(4-Methylquinolin-2-yl)sulfanylacetonitrile
The XLogP value of 3.1589 indicates that 2-(4-Methylquinolin-2-yl)sulfanylacetonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 36.68 Ų, 2-(4-Methylquinolin-2-yl)sulfanylacetonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(4-Methylquinolin-2-yl)sulfanylacetonitrile has 0 hydrogen bond donor(s) and 3 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-Methylquinolin-2-yl)sulfanylacetonitrile?
The CAS number of 2-(4-Methylquinolin-2-yl)sulfanylacetonitrile is 7521-23-5.
What is the molecular formula of 2-(4-Methylquinolin-2-yl)sulfanylacetonitrile?
The molecular formula of 2-(4-Methylquinolin-2-yl)sulfanylacetonitrile is C12H10N2S.
What is the molecular weight of 2-(4-Methylquinolin-2-yl)sulfanylacetonitrile?
The molecular weight of 2-(4-Methylquinolin-2-yl)sulfanylacetonitrile is 214.06 g/mol.
Where can I buy 2-(4-Methylquinolin-2-yl)sulfanylacetonitrile?
You can request a quote for 2-(4-Methylquinolin-2-yl)sulfanylacetonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(4-Methylquinolin-2-yl)sulfanylacetonitrile?
Yes, KEHONG BIO provides custom synthesis services for 2-(4-Methylquinolin-2-yl)sulfanylacetonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.