2-(Methylthio)nicotinamide
TL;DR: 2-(Methylthio)nicotinamide (CAS 175135-28-1) is a chemical compound with molecular formula C7H8N2OS and molecular weight 168.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methylsulfanylpyridine-3-carboxamide
Also Known As: 2-(methylthio)nicotinamide, Maybridge1_001564, 2-methylsulfanylpyridine-3-carboxamide, 2-(methylsulfanyl)pyridine-3-carboxamide, 2-methylthiopyridine-3-carboxamide
| Molecular Formula | C7H8N2OS |
|---|---|
| Molecular Weight | 168.04 g/mol |
| LogP | 0.9024 |
| Topological Polar Surface Area | 55.98 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 168.03574 |
| Heavy Atoms | 11 |
| Complexity | 274.898 |
Chemical Identifiers
| CAS Number | 175135-28-1 |
|---|---|
| SMILES | CSC1=C(C=CC=N1)C(=O)N |
Product Overview
2-(Methylthio)nicotinamide (CAS 175135-28-1), with molecular formula C7H8N2OS and molecular weight 168.04 g/mol. IUPAC: 2-methylsulfanylpyridine-3-carboxamide.
Chemical Property Profile of 2-(Methylthio)nicotinamide
Property Insights of 2-(Methylthio)nicotinamide
The XLogP value of 0.9024 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(Methylthio)nicotinamide. With a topological polar surface area (TPSA) of 55.98 Ų, 2-(Methylthio)nicotinamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(Methylthio)nicotinamide has 1 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-(Methylthio)nicotinamide?
The CAS number of 2-(Methylthio)nicotinamide is 175135-28-1.
What is the molecular formula of 2-(Methylthio)nicotinamide?
The molecular formula of 2-(Methylthio)nicotinamide is C7H8N2OS.
What is the molecular weight of 2-(Methylthio)nicotinamide?
The molecular weight of 2-(Methylthio)nicotinamide is 168.04 g/mol.
Where can I buy 2-(Methylthio)nicotinamide?
You can request a quote for 2-(Methylthio)nicotinamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(Methylthio)nicotinamide?
Yes, KEHONG BIO provides custom synthesis services for 2-(Methylthio)nicotinamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.