![2-[(Carbamoylmethyl)sulfanyl]pyridine-3-carboxylic acid structure](/static/products/852/852695-22-8.png)
2-[(Carbamoylmethyl)sulfanyl]pyridine-3-carboxylic acid
TL;DR: 2-[(Carbamoylmethyl)sulfanyl]pyridine-3-carboxylic acid (CAS 852695-22-8) is a chemical compound with molecular formula C8H8N2O3S and molecular weight 212.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2-amino-2-oxoethyl)sulfanylpyridine-3-carboxylic acid
Also Known As: 2-[(carbamoylmethyl)sulfanyl]pyridine-3-carboxylic acid, 2-[(2-amino-2-oxoethyl)thio]nicotinic acid, 2-((2-Amino-2-oxoethyl)thio)nicotinic acid, 2-(2-amino-2-oxoethyl)sulfanylpyridine-3-carboxylic acid, 2-(carbamoylmethylthio)pyridine-3-carboxylic acid
| Molecular Formula | C8H8N2O3S |
|---|---|
| Molecular Weight | 212.03 g/mol |
| LogP | 0.3572 |
| Topological Polar Surface Area | 93.28 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 212.02556 |
| Heavy Atoms | 14 |
| Complexity | 367.35895 |
Chemical Identifiers
| CAS Number | 852695-22-8 |
|---|---|
| SMILES | C1=CC(=C(N=C1)SCC(=O)N)C(=O)O |
Product Overview
2-[(Carbamoylmethyl)sulfanyl]pyridine-3-carboxylic acid (CAS 852695-22-8), with molecular formula C8H8N2O3S and molecular weight 212.03 g/mol. IUPAC: 2-(2-amino-2-oxoethyl)sulfanylpyridine-3-carboxylic acid.
Chemical Property Profile of 2-[(Carbamoylmethyl)sulfanyl]pyridine-3-carboxylic acid
Property Insights of 2-[(Carbamoylmethyl)sulfanyl]pyridine-3-carboxylic acid
The XLogP value of 0.3572 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[(Carbamoylmethyl)sulfanyl]pyridine-3-carboxylic acid. The TPSA of 93.28 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[(Carbamoylmethyl)sulfanyl]pyridine-3-carboxylic acid. Following Lipinski's Rule of Five, 2-[(Carbamoylmethyl)sulfanyl]pyridine-3-carboxylic acid has 2 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 2-[(Carbamoylmethyl)sulfanyl]pyridine-3-carboxylic acid?
The CAS number of 2-[(Carbamoylmethyl)sulfanyl]pyridine-3-carboxylic acid is 852695-22-8.
What is the molecular formula of 2-[(Carbamoylmethyl)sulfanyl]pyridine-3-carboxylic acid?
The molecular formula of 2-[(Carbamoylmethyl)sulfanyl]pyridine-3-carboxylic acid is C8H8N2O3S.
What is the molecular weight of 2-[(Carbamoylmethyl)sulfanyl]pyridine-3-carboxylic acid?
The molecular weight of 2-[(Carbamoylmethyl)sulfanyl]pyridine-3-carboxylic acid is 212.03 g/mol.
Where can I buy 2-[(Carbamoylmethyl)sulfanyl]pyridine-3-carboxylic acid?
You can request a quote for 2-[(Carbamoylmethyl)sulfanyl]pyridine-3-carboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[(Carbamoylmethyl)sulfanyl]pyridine-3-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-[(Carbamoylmethyl)sulfanyl]pyridine-3-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.