5-(Methylthio)nicotinic acid
TL;DR: 5-(Methylthio)nicotinic acid (CAS 74470-28-3) is a chemical compound with molecular formula C7H7NO2S and molecular weight 169.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-methylsulfanylpyridine-3-carboxylic acid
Also Known As: 5-(Methylthio)nicotinic acid, 5-methylsulfanylpyridine-3-carboxylic Acid, 5-(Methylthio)nicotinicacid, 5-(METHYLSULFANYL)PYRIDINE-3-CARBOXYLIC ACID, 5-(Methylthio)-3-pyridinecarboxylic acid
| Molecular Formula | C7H7NO2S |
|---|---|
| Molecular Weight | 169.02 g/mol |
| LogP | 1.5017 |
| Topological Polar Surface Area | 50.19 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 169.01974 |
| Heavy Atoms | 11 |
| Complexity | 274.898 |
Chemical Identifiers
| CAS Number | 74470-28-3 |
|---|---|
| SMILES | CSC1=CN=CC(=C1)C(=O)O |
Product Overview
5-(Methylthio)nicotinic acid (CAS 74470-28-3), with molecular formula C7H7NO2S and molecular weight 169.02 g/mol. IUPAC: 5-methylsulfanylpyridine-3-carboxylic acid.
Chemical Property Profile of 5-(Methylthio)nicotinic acid
Property Insights of 5-(Methylthio)nicotinic acid
The XLogP value of 1.5017 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-(Methylthio)nicotinic acid. With a topological polar surface area (TPSA) of 50.19 Ų, 5-(Methylthio)nicotinic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-(Methylthio)nicotinic acid 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 5-(Methylthio)nicotinic acid?
The CAS number of 5-(Methylthio)nicotinic acid is 74470-28-3.
What is the molecular formula of 5-(Methylthio)nicotinic acid?
The molecular formula of 5-(Methylthio)nicotinic acid is C7H7NO2S.
What is the molecular weight of 5-(Methylthio)nicotinic acid?
The molecular weight of 5-(Methylthio)nicotinic acid is 169.02 g/mol.
Where can I buy 5-(Methylthio)nicotinic acid?
You can request a quote for 5-(Methylthio)nicotinic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-(Methylthio)nicotinic acid?
Yes, KEHONG BIO provides custom synthesis services for 5-(Methylthio)nicotinic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.