Ethyl 2-(pyridin-2-ylthio)acetate
TL;DR: Ethyl 2-(pyridin-2-ylthio)acetate (CAS 28856-92-0) is a chemical compound with molecular formula C9H11NO2S and molecular weight 197.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-pyridin-2-ylsulfanylacetate
Also Known As: Ethyl 2-(pyridin-2-ylthio)acetate, Ethyl ester, Aceticacid, -,ethylester, Ethyl 2-pyridin-2-ylsulfanylacetate, Ethyl 2-(pyridin-2-ylsulfanyl)acetate
| Molecular Formula | C9H11NO2S |
|---|---|
| Molecular Weight | 197.05 g/mol |
| LogP | 1.7368 |
| Topological Polar Surface Area | 39.19 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 197.05106 |
| Heavy Atoms | 13 |
| Complexity | 263.57703 |
Chemical Identifiers
| CAS Number | 28856-92-0 |
|---|---|
| SMILES | CCOC(=O)CSC1=CC=CC=N1 |
Product Overview
Ethyl 2-(pyridin-2-ylthio)acetate (CAS 28856-92-0), with molecular formula C9H11NO2S and molecular weight 197.05 g/mol. IUPAC: ethyl 2-pyridin-2-ylsulfanylacetate.
Chemical Property Profile of Ethyl 2-(pyridin-2-ylthio)acetate
Property Insights of Ethyl 2-(pyridin-2-ylthio)acetate
The XLogP value of 1.7368 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 2-(pyridin-2-ylthio)acetate. With a topological polar surface area (TPSA) of 39.19 Ų, Ethyl 2-(pyridin-2-ylthio)acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl 2-(pyridin-2-ylthio)acetate has 0 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 Ethyl 2-(pyridin-2-ylthio)acetate?
The CAS number of Ethyl 2-(pyridin-2-ylthio)acetate is 28856-92-0.
What is the molecular formula of Ethyl 2-(pyridin-2-ylthio)acetate?
The molecular formula of Ethyl 2-(pyridin-2-ylthio)acetate is C9H11NO2S.
What is the molecular weight of Ethyl 2-(pyridin-2-ylthio)acetate?
The molecular weight of Ethyl 2-(pyridin-2-ylthio)acetate is 197.05 g/mol.
Where can I buy Ethyl 2-(pyridin-2-ylthio)acetate?
You can request a quote for Ethyl 2-(pyridin-2-ylthio)acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 2-(pyridin-2-ylthio)acetate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 2-(pyridin-2-ylthio)acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.