2-(Methylthio)-4-phenyl-6-(p-tolyl)nicotinonitrile
TL;DR: 2-(Methylthio)-4-phenyl-6-(p-tolyl)nicotinonitrile (CAS 372156-53-1) is a chemical compound with molecular formula C20H16N2S and molecular weight 316.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-(4-methylphenyl)-2-methylsulfanyl-4-phenylpyridine-3-carbonitrile
Also Known As: 2-(methylthio)-4-phenyl-6-(p-tolyl)nicotinonitrile, 6-(4-methylphenyl)-2-methylsulfanyl-4-phenylpyridine-3-carbonitrile
| Molecular Formula | C20H16N2S |
|---|---|
| Molecular Weight | 316.10 g/mol |
| LogP | 5.3176 |
| Topological Polar Surface Area | 36.68 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 316.10342 |
| Heavy Atoms | 23 |
| Complexity | 862.6387 |
Chemical Identifiers
| CAS Number | 372156-53-1 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C2=NC(=C(C(=C2)C3=CC=CC=C3)C#N)SC |
Product Overview
2-(Methylthio)-4-phenyl-6-(p-tolyl)nicotinonitrile (CAS 372156-53-1), with molecular formula C20H16N2S and molecular weight 316.10 g/mol. IUPAC: 6-(4-methylphenyl)-2-methylsulfanyl-4-phenylpyridine-3-carbonitrile.
Chemical Property Profile of 2-(Methylthio)-4-phenyl-6-(p-tolyl)nicotinonitrile
Property Insights of 2-(Methylthio)-4-phenyl-6-(p-tolyl)nicotinonitrile
The XLogP value of 5.3176 indicates that 2-(Methylthio)-4-phenyl-6-(p-tolyl)nicotinonitrile 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-(Methylthio)-4-phenyl-6-(p-tolyl)nicotinonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(Methylthio)-4-phenyl-6-(p-tolyl)nicotinonitrile has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-(Methylthio)-4-phenyl-6-(p-tolyl)nicotinonitrile?
The CAS number of 2-(Methylthio)-4-phenyl-6-(p-tolyl)nicotinonitrile is 372156-53-1.
What is the molecular formula of 2-(Methylthio)-4-phenyl-6-(p-tolyl)nicotinonitrile?
The molecular formula of 2-(Methylthio)-4-phenyl-6-(p-tolyl)nicotinonitrile is C20H16N2S.
What is the molecular weight of 2-(Methylthio)-4-phenyl-6-(p-tolyl)nicotinonitrile?
The molecular weight of 2-(Methylthio)-4-phenyl-6-(p-tolyl)nicotinonitrile is 316.10 g/mol.
Where can I buy 2-(Methylthio)-4-phenyl-6-(p-tolyl)nicotinonitrile?
You can request a quote for 2-(Methylthio)-4-phenyl-6-(p-tolyl)nicotinonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(Methylthio)-4-phenyl-6-(p-tolyl)nicotinonitrile?
Yes, KEHONG BIO provides custom synthesis services for 2-(Methylthio)-4-phenyl-6-(p-tolyl)nicotinonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.