6-Methyl-2-(methylthio)-5-(phenylglycyl)nicotinonitrile
TL;DR: 6-Methyl-2-(methylthio)-5-(phenylglycyl)nicotinonitrile (CAS 329908-83-0) is a chemical compound with molecular formula C16H15N3OS and molecular weight 297.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(2-anilinoacetyl)-6-methyl-2-methylsulfanylpyridine-3-carbonitrile
Also Known As: starbld0003425, 6-Methyl-2-(methylthio)-5-(phenylglycyl)nicotinonitrile, 5-anilinoacetyl-3-cyano-6-methyl-2-methylthiopyridine, 5-(2-anilinoacetyl)-6-methyl-2-methylsulfanylpyridine-3-carbonitrile, 6-methyl-2-(methylsulfanyl)-5-[2-(phenylamino)acetyl]pyridine-3-carbonitrile
| Molecular Formula | C16H15N3OS |
|---|---|
| Molecular Weight | 297.09 g/mol |
| LogP | 3.2784 |
| Topological Polar Surface Area | 65.78 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 297.0936 |
| Heavy Atoms | 21 |
| Complexity | 692.65857 |
Chemical Identifiers
| CAS Number | 329908-83-0 |
|---|---|
| SMILES | CC1=C(C=C(C(=N1)SC)C#N)C(=O)CNC2=CC=CC=C2 |
Product Overview
6-Methyl-2-(methylthio)-5-(phenylglycyl)nicotinonitrile (CAS 329908-83-0), with molecular formula C16H15N3OS and molecular weight 297.09 g/mol. IUPAC: 5-(2-anilinoacetyl)-6-methyl-2-methylsulfanylpyridine-3-carbonitrile.
Chemical Property Profile of 6-Methyl-2-(methylthio)-5-(phenylglycyl)nicotinonitrile
Property Insights of 6-Methyl-2-(methylthio)-5-(phenylglycyl)nicotinonitrile
The XLogP value of 3.2784 indicates that 6-Methyl-2-(methylthio)-5-(phenylglycyl)nicotinonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 65.78 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-Methyl-2-(methylthio)-5-(phenylglycyl)nicotinonitrile. Following Lipinski's Rule of Five, 6-Methyl-2-(methylthio)-5-(phenylglycyl)nicotinonitrile has 1 hydrogen bond donor(s) and 5 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-(methylthio)-5-(phenylglycyl)nicotinonitrile?
The CAS number of 6-Methyl-2-(methylthio)-5-(phenylglycyl)nicotinonitrile is 329908-83-0.
What is the molecular formula of 6-Methyl-2-(methylthio)-5-(phenylglycyl)nicotinonitrile?
The molecular formula of 6-Methyl-2-(methylthio)-5-(phenylglycyl)nicotinonitrile is C16H15N3OS.
What is the molecular weight of 6-Methyl-2-(methylthio)-5-(phenylglycyl)nicotinonitrile?
The molecular weight of 6-Methyl-2-(methylthio)-5-(phenylglycyl)nicotinonitrile is 297.09 g/mol.
Where can I buy 6-Methyl-2-(methylthio)-5-(phenylglycyl)nicotinonitrile?
You can request a quote for 6-Methyl-2-(methylthio)-5-(phenylglycyl)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-(methylthio)-5-(phenylglycyl)nicotinonitrile?
Yes, KEHONG BIO provides custom synthesis services for 6-Methyl-2-(methylthio)-5-(phenylglycyl)nicotinonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.