![6-[(2-Oxopropyl)sulfanyl]nicotinic acid structure](/static/products/353/353282-07-2.png)
6-[(2-Oxopropyl)sulfanyl]nicotinic acid
TL;DR: 6-[(2-Oxopropyl)sulfanyl]nicotinic acid (CAS 353282-07-2) is a chemical compound with molecular formula C9H9NO3S and molecular weight 211.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-(2-oxopropylsulfanyl)pyridine-3-carboxylic acid
Also Known As: 6-[(2-oxopropyl)sulfanyl]nicotinic acid, 6-(2-oxopropylsulfanyl)pyridine-3-carboxylic acid, AJ-333/36117039, 6-(2-oxopropylthio)-3-pyridinecarboxylic acid
| Molecular Formula | C9H9NO3S |
|---|---|
| Molecular Weight | 211.03 g/mol |
| LogP | 1.4609 |
| Topological Polar Surface Area | 67.26 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 211.03032 |
| Heavy Atoms | 14 |
| Complexity | 347.57962 |
Chemical Identifiers
| CAS Number | 353282-07-2 |
|---|---|
| SMILES | CC(=O)CSC1=NC=C(C=C1)C(=O)O |
Product Overview
6-[(2-Oxopropyl)sulfanyl]nicotinic acid (CAS 353282-07-2), with molecular formula C9H9NO3S and molecular weight 211.03 g/mol. IUPAC: 6-(2-oxopropylsulfanyl)pyridine-3-carboxylic acid.
Chemical Property Profile of 6-[(2-Oxopropyl)sulfanyl]nicotinic acid
Property Insights of 6-[(2-Oxopropyl)sulfanyl]nicotinic acid
The XLogP value of 1.4609 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-[(2-Oxopropyl)sulfanyl]nicotinic acid. The TPSA of 67.26 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-[(2-Oxopropyl)sulfanyl]nicotinic acid. Following Lipinski's Rule of Five, 6-[(2-Oxopropyl)sulfanyl]nicotinic acid has 1 hydrogen bond donor(s) and 4 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-[(2-Oxopropyl)sulfanyl]nicotinic acid?
The CAS number of 6-[(2-Oxopropyl)sulfanyl]nicotinic acid is 353282-07-2.
What is the molecular formula of 6-[(2-Oxopropyl)sulfanyl]nicotinic acid?
The molecular formula of 6-[(2-Oxopropyl)sulfanyl]nicotinic acid is C9H9NO3S.
What is the molecular weight of 6-[(2-Oxopropyl)sulfanyl]nicotinic acid?
The molecular weight of 6-[(2-Oxopropyl)sulfanyl]nicotinic acid is 211.03 g/mol.
Where can I buy 6-[(2-Oxopropyl)sulfanyl]nicotinic acid?
You can request a quote for 6-[(2-Oxopropyl)sulfanyl]nicotinic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-[(2-Oxopropyl)sulfanyl]nicotinic acid?
Yes, KEHONG BIO provides custom synthesis services for 6-[(2-Oxopropyl)sulfanyl]nicotinic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.