6-(benzylthio)-5-cyano-2-methyl-4-(thiophen-2-yl)-N-(o-tolyl)nicotinamide
TL;DR: 6-(benzylthio)-5-cyano-2-methyl-4-(thiophen-2-yl)-N-(o-tolyl)nicotinamide (CAS 370074-31-0) is a chemical compound with molecular formula C26H21N3OS2 and molecular weight 455.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-benzylsulfanyl-5-cyano-2-methyl-N-(2-methylphenyl)-4-thiophen-2-ylpyridine-3-carboxamide
Also Known As: 6-(benzylthio)-5-cyano-2-methyl-4-(thiophen-2-yl)-N-(o-tolyl)nicotinamide, 6-benzylsulfanyl-5-cyano-2-methyl-N-(2-methylphenyl)-4-thiophen-2-ylpyridine-3-carboxamide, 6-(benzylsulfanyl)-5-cyano-2-methyl-N-(2-methylphenyl)-4-(thiophen-2-yl)pyridine-3-carboxamide, 6-benzylsulfanyl-5-cyano-2-methyl-N-(2-methylphenyl)-4-thiophen-2-yl-pyridine-3-carboxamide
| Molecular Formula | C26H21N3OS2 |
|---|---|
| Molecular Weight | 455.11 g/mol |
| LogP | 6.84322 |
| Topological Polar Surface Area | 65.78 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 455.1126 |
| Heavy Atoms | 32 |
| Complexity | 1292.904 |
Chemical Identifiers
| CAS Number | 370074-31-0 |
|---|---|
| SMILES | CC1=CC=CC=C1NC(=O)C2=C(N=C(C(=C2C3=CC=CS3)C#N)SCC4=CC=CC=C4)C |
Product Overview
6-(benzylthio)-5-cyano-2-methyl-4-(thiophen-2-yl)-N-(o-tolyl)nicotinamide (CAS 370074-31-0), with molecular formula C26H21N3OS2 and molecular weight 455.11 g/mol. IUPAC: 6-benzylsulfanyl-5-cyano-2-methyl-N-(2-methylphenyl)-4-thiophen-2-ylpyridine-3-carboxamide.
Chemical Property Profile of 6-(benzylthio)-5-cyano-2-methyl-4-(thiophen-2-yl)-N-(o-tolyl)nicotinamide
Property Insights of 6-(benzylthio)-5-cyano-2-methyl-4-(thiophen-2-yl)-N-(o-tolyl)nicotinamide
The XLogP value of 6.84322 indicates that 6-(benzylthio)-5-cyano-2-methyl-4-(thiophen-2-yl)-N-(o-tolyl)nicotinamide 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-(benzylthio)-5-cyano-2-methyl-4-(thiophen-2-yl)-N-(o-tolyl)nicotinamide. Following Lipinski's Rule of Five, 6-(benzylthio)-5-cyano-2-methyl-4-(thiophen-2-yl)-N-(o-tolyl)nicotinamide has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 6-(benzylthio)-5-cyano-2-methyl-4-(thiophen-2-yl)-N-(o-tolyl)nicotinamide?
The CAS number of 6-(benzylthio)-5-cyano-2-methyl-4-(thiophen-2-yl)-N-(o-tolyl)nicotinamide is 370074-31-0.
What is the molecular formula of 6-(benzylthio)-5-cyano-2-methyl-4-(thiophen-2-yl)-N-(o-tolyl)nicotinamide?
The molecular formula of 6-(benzylthio)-5-cyano-2-methyl-4-(thiophen-2-yl)-N-(o-tolyl)nicotinamide is C26H21N3OS2.
What is the molecular weight of 6-(benzylthio)-5-cyano-2-methyl-4-(thiophen-2-yl)-N-(o-tolyl)nicotinamide?
The molecular weight of 6-(benzylthio)-5-cyano-2-methyl-4-(thiophen-2-yl)-N-(o-tolyl)nicotinamide is 455.11 g/mol.
Where can I buy 6-(benzylthio)-5-cyano-2-methyl-4-(thiophen-2-yl)-N-(o-tolyl)nicotinamide?
You can request a quote for 6-(benzylthio)-5-cyano-2-methyl-4-(thiophen-2-yl)-N-(o-tolyl)nicotinamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-(benzylthio)-5-cyano-2-methyl-4-(thiophen-2-yl)-N-(o-tolyl)nicotinamide?
Yes, KEHONG BIO provides custom synthesis services for 6-(benzylthio)-5-cyano-2-methyl-4-(thiophen-2-yl)-N-(o-tolyl)nicotinamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.