![Ethyl {[3-cyano-4-(4-fluorophenyl)-6-thien-2-ylpyridin-2-yl]thio}acetate structure](/static/products/300/300844-08-0.png)
Ethyl {[3-cyano-4-(4-fluorophenyl)-6-thien-2-ylpyridin-2-yl]thio}acetate
TL;DR: Ethyl {[3-cyano-4-(4-fluorophenyl)-6-thien-2-ylpyridin-2-yl]thio}acetate (CAS 300844-08-0) is a chemical compound with molecular formula C20H15FN2O2S2 and molecular weight 398.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[[3-cyano-4-(4-fluorophenyl)-6-thiophen-2-yl-2-pyridinyl]sulfanyl]acetate
Also Known As: A0237/0010643, ethyl {[3-cyano-4-(4-fluorophenyl)-6-thien-2-ylpyridin-2-yl]thio}acetate, ethyl 2-[3-cyano-4-(4-fluorophenyl)-6-(2-thienyl)-2-pyridylthio]acetate, ethyl {[3-cyano-4-(4-fluorophenyl)-6-(thiophen-2-yl)pyridin-2-yl]sulfanyl}acetate, ethyl 2-((3-cyano-4-(4-fluorophenyl)-6-(thiophen-2-yl)pyridin-2-yl)thio)acetate
| Molecular Formula | C20H15FN2O2S2 |
|---|---|
| Molecular Weight | 398.06 g/mol |
| LogP | 5.14308 |
| Topological Polar Surface Area | 62.98 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 398.0559 |
| Heavy Atoms | 27 |
| Complexity | 980.4615 |
Chemical Identifiers
| CAS Number | 300844-08-0 |
|---|---|
| SMILES | CCOC(=O)CSC1=C(C(=CC(=N1)C2=CC=CS2)C3=CC=C(C=C3)F)C#N |
Product Overview
Ethyl {[3-cyano-4-(4-fluorophenyl)-6-thien-2-ylpyridin-2-yl]thio}acetate (CAS 300844-08-0), with molecular formula C20H15FN2O2S2 and molecular weight 398.06 g/mol. IUPAC: ethyl 2-[[3-cyano-4-(4-fluorophenyl)-6-thiophen-2-yl-2-pyridinyl]sulfanyl]acetate.
Chemical Property Profile of Ethyl {[3-cyano-4-(4-fluorophenyl)-6-thien-2-ylpyridin-2-yl]thio}acetate
Property Insights of Ethyl {[3-cyano-4-(4-fluorophenyl)-6-thien-2-ylpyridin-2-yl]thio}acetate
The XLogP value of 5.14308 indicates that Ethyl {[3-cyano-4-(4-fluorophenyl)-6-thien-2-ylpyridin-2-yl]thio}acetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 62.98 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl {[3-cyano-4-(4-fluorophenyl)-6-thien-2-ylpyridin-2-yl]thio}acetate. Following Lipinski's Rule of Five, Ethyl {[3-cyano-4-(4-fluorophenyl)-6-thien-2-ylpyridin-2-yl]thio}acetate has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Ethyl {[3-cyano-4-(4-fluorophenyl)-6-thien-2-ylpyridin-2-yl]thio}acetate?
The CAS number of Ethyl {[3-cyano-4-(4-fluorophenyl)-6-thien-2-ylpyridin-2-yl]thio}acetate is 300844-08-0.
What is the molecular formula of Ethyl {[3-cyano-4-(4-fluorophenyl)-6-thien-2-ylpyridin-2-yl]thio}acetate?
The molecular formula of Ethyl {[3-cyano-4-(4-fluorophenyl)-6-thien-2-ylpyridin-2-yl]thio}acetate is C20H15FN2O2S2.
What is the molecular weight of Ethyl {[3-cyano-4-(4-fluorophenyl)-6-thien-2-ylpyridin-2-yl]thio}acetate?
The molecular weight of Ethyl {[3-cyano-4-(4-fluorophenyl)-6-thien-2-ylpyridin-2-yl]thio}acetate is 398.06 g/mol.
Where can I buy Ethyl {[3-cyano-4-(4-fluorophenyl)-6-thien-2-ylpyridin-2-yl]thio}acetate?
You can request a quote for Ethyl {[3-cyano-4-(4-fluorophenyl)-6-thien-2-ylpyridin-2-yl]thio}acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl {[3-cyano-4-(4-fluorophenyl)-6-thien-2-ylpyridin-2-yl]thio}acetate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl {[3-cyano-4-(4-fluorophenyl)-6-thien-2-ylpyridin-2-yl]thio}acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.