(3-Cyano-6-hydroxy-4-methyl-pyridin-2-ylsulfanyl)-acetic acid methyl ester
TL;DR: (3-Cyano-6-hydroxy-4-methyl-pyridin-2-ylsulfanyl)-acetic acid methyl ester (CAS 202519-91-3) is a chemical compound with molecular formula C10H10N2O3S and molecular weight 238.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[(3-cyano-4-methyl-6-oxo-1H-pyridin-2-yl)sulfanyl]acetate
Also Known As: methyl 2-((3-cyano-6-hydroxy-4-methylpyridin-2-yl)thio)acetate, (3-Cyano-6-hydroxy-4-methyl-pyridin-2-ylsulfanyl)-acetic acid methyl ester, methyl 2-[(3-cyano-4-methyl-6-oxo-1H-pyridin-2-yl)sulfanyl]acetate
| Molecular Formula | C10H10N2O3S |
|---|---|
| Molecular Weight | 238.04 g/mol |
| LogP | 0.8201 |
| Topological Polar Surface Area | 82.95 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 238.04121 |
| Heavy Atoms | 16 |
| Complexity | 501.76608 |
Chemical Identifiers
| CAS Number | 202519-91-3 |
|---|---|
| SMILES | CC1=CC(=O)NC(=C1C#N)SCC(=O)OC |
Product Overview
(3-Cyano-6-hydroxy-4-methyl-pyridin-2-ylsulfanyl)-acetic acid methyl ester (CAS 202519-91-3), with molecular formula C10H10N2O3S and molecular weight 238.04 g/mol. IUPAC: methyl 2-[(3-cyano-4-methyl-6-oxo-1H-pyridin-2-yl)sulfanyl]acetate.
Chemical Property Profile of (3-Cyano-6-hydroxy-4-methyl-pyridin-2-ylsulfanyl)-acetic acid methyl ester
Property Insights of (3-Cyano-6-hydroxy-4-methyl-pyridin-2-ylsulfanyl)-acetic acid methyl ester
The XLogP value of 0.8201 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (3-Cyano-6-hydroxy-4-methyl-pyridin-2-ylsulfanyl)-acetic acid methyl ester. The TPSA of 82.95 Ų falls within the moderate polarity range, balancing permeability and solubility for (3-Cyano-6-hydroxy-4-methyl-pyridin-2-ylsulfanyl)-acetic acid methyl ester. Following Lipinski's Rule of Five, (3-Cyano-6-hydroxy-4-methyl-pyridin-2-ylsulfanyl)-acetic acid methyl ester has 1 hydrogen bond donor(s) and 5 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 (3-Cyano-6-hydroxy-4-methyl-pyridin-2-ylsulfanyl)-acetic acid methyl ester?
The CAS number of (3-Cyano-6-hydroxy-4-methyl-pyridin-2-ylsulfanyl)-acetic acid methyl ester is 202519-91-3.
What is the molecular formula of (3-Cyano-6-hydroxy-4-methyl-pyridin-2-ylsulfanyl)-acetic acid methyl ester?
The molecular formula of (3-Cyano-6-hydroxy-4-methyl-pyridin-2-ylsulfanyl)-acetic acid methyl ester is C10H10N2O3S.
What is the molecular weight of (3-Cyano-6-hydroxy-4-methyl-pyridin-2-ylsulfanyl)-acetic acid methyl ester?
The molecular weight of (3-Cyano-6-hydroxy-4-methyl-pyridin-2-ylsulfanyl)-acetic acid methyl ester is 238.04 g/mol.
Where can I buy (3-Cyano-6-hydroxy-4-methyl-pyridin-2-ylsulfanyl)-acetic acid methyl ester?
You can request a quote for (3-Cyano-6-hydroxy-4-methyl-pyridin-2-ylsulfanyl)-acetic acid methyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (3-Cyano-6-hydroxy-4-methyl-pyridin-2-ylsulfanyl)-acetic acid methyl ester?
Yes, KEHONG BIO provides custom synthesis services for (3-Cyano-6-hydroxy-4-methyl-pyridin-2-ylsulfanyl)-acetic acid methyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.