2-(Propylthio)nicotinamide
TL;DR: 2-(Propylthio)nicotinamide (CAS 175135-26-9) is a chemical compound with molecular formula C9H12N2OS and molecular weight 196.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-propylsulfanylpyridine-3-carboxamide
Also Known As: 2-(propylthio)nicotinamide, 2-(n-Propylthio)nicotinamide, Maybridge1_001275, 2-propylsulfanylpyridine-3-carboxamide, 3-Pyridinecarboxamide, 2-(propylthio)-
| Molecular Formula | C9H12N2OS |
|---|---|
| Molecular Weight | 196.07 g/mol |
| LogP | 1.6826 |
| Topological Polar Surface Area | 55.98 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 196.06703 |
| Heavy Atoms | 13 |
| Complexity | 301.4211 |
Chemical Identifiers
| CAS Number | 175135-26-9 |
|---|---|
| SMILES | CCCSC1=C(C=CC=N1)C(=O)N |
Product Overview
2-(Propylthio)nicotinamide (CAS 175135-26-9), with molecular formula C9H12N2OS and molecular weight 196.07 g/mol. IUPAC: 2-propylsulfanylpyridine-3-carboxamide.
Chemical Property Profile of 2-(Propylthio)nicotinamide
Property Insights of 2-(Propylthio)nicotinamide
The XLogP value of 1.6826 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(Propylthio)nicotinamide. With a topological polar surface area (TPSA) of 55.98 Ų, 2-(Propylthio)nicotinamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(Propylthio)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-(Propylthio)nicotinamide?
The CAS number of 2-(Propylthio)nicotinamide is 175135-26-9.
What is the molecular formula of 2-(Propylthio)nicotinamide?
The molecular formula of 2-(Propylthio)nicotinamide is C9H12N2OS.
What is the molecular weight of 2-(Propylthio)nicotinamide?
The molecular weight of 2-(Propylthio)nicotinamide is 196.07 g/mol.
Where can I buy 2-(Propylthio)nicotinamide?
You can request a quote for 2-(Propylthio)nicotinamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(Propylthio)nicotinamide?
Yes, KEHONG BIO provides custom synthesis services for 2-(Propylthio)nicotinamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.