![Ethyl 2-cyano-2-[4-(2-ethoxy-2-oxoethyl)-3-phenyl-1,3-thiazol-2-ylidene]acetate structure](/static/products/846/84645-52-3.png)
Ethyl 2-cyano-2-[4-(2-ethoxy-2-oxoethyl)-3-phenyl-1,3-thiazol-2-ylidene]acetate
TL;DR: Ethyl 2-cyano-2-[4-(2-ethoxy-2-oxoethyl)-3-phenyl-1,3-thiazol-2-ylidene]acetate (CAS 84645-52-3) is a chemical compound with molecular formula C18H18N2O4S and molecular weight 358.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-cyano-2-[4-(2-ethoxy-2-oxoethyl)-3-phenyl-1,3-thiazol-2-ylidene]acetate
Also Known As: ethyl (2E)-2-cyano-2-[4-(2-ethoxy-2-oxoethyl)-3-phenyl-1,3-t, ethyl 2-cyano-2-[4-(2-ethoxy-2-oxoethyl)-3-phenyl-1,3-thiazol-2-ylidene]acetate
| Molecular Formula | C18H18N2O4S |
|---|---|
| Molecular Weight | 358.10 g/mol |
| LogP | 3.0 |
| Topological Polar Surface Area | 105.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 358.09872 |
| Heavy Atoms | 25 |
| Complexity | 626.0 |
Chemical Identifiers
| CAS Number | 84645-52-3 |
|---|---|
| SMILES | CCOC(=O)CC1=CSC(=C(C#N)C(=O)OCC)N1C2=CC=CC=C2 |
| InChIKey | GQLHRVNLGVCVLK-UHFFFAOYSA-N |
Product Overview
Ethyl 2-cyano-2-[4-(2-ethoxy-2-oxoethyl)-3-phenyl-1,3-thiazol-2-ylidene]acetate (CAS 84645-52-3), with molecular formula C18H18N2O4S and molecular weight 358.10 g/mol. IUPAC: ethyl 2-cyano-2-[4-(2-ethoxy-2-oxoethyl)-3-phenyl-1,3-thiazol-2-ylidene]acetate.
Chemical Property Profile of Ethyl 2-cyano-2-[4-(2-ethoxy-2-oxoethyl)-3-phenyl-1,3-thiazol-2-ylidene]acetate
Property Insights of Ethyl 2-cyano-2-[4-(2-ethoxy-2-oxoethyl)-3-phenyl-1,3-thiazol-2-ylidene]acetate
The XLogP value of 3.0 indicates that Ethyl 2-cyano-2-[4-(2-ethoxy-2-oxoethyl)-3-phenyl-1,3-thiazol-2-ylidene]acetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 105.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 2-cyano-2-[4-(2-ethoxy-2-oxoethyl)-3-phenyl-1,3-thiazol-2-ylidene]acetate. Following Lipinski's Rule of Five, Ethyl 2-cyano-2-[4-(2-ethoxy-2-oxoethyl)-3-phenyl-1,3-thiazol-2-ylidene]acetate has 0 hydrogen bond donor(s) and 7 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-cyano-2-[4-(2-ethoxy-2-oxoethyl)-3-phenyl-1,3-thiazol-2-ylidene]acetate?
The CAS number of Ethyl 2-cyano-2-[4-(2-ethoxy-2-oxoethyl)-3-phenyl-1,3-thiazol-2-ylidene]acetate is 84645-52-3.
What is the molecular formula of Ethyl 2-cyano-2-[4-(2-ethoxy-2-oxoethyl)-3-phenyl-1,3-thiazol-2-ylidene]acetate?
The molecular formula of Ethyl 2-cyano-2-[4-(2-ethoxy-2-oxoethyl)-3-phenyl-1,3-thiazol-2-ylidene]acetate is C18H18N2O4S.
What is the molecular weight of Ethyl 2-cyano-2-[4-(2-ethoxy-2-oxoethyl)-3-phenyl-1,3-thiazol-2-ylidene]acetate?
The molecular weight of Ethyl 2-cyano-2-[4-(2-ethoxy-2-oxoethyl)-3-phenyl-1,3-thiazol-2-ylidene]acetate is 358.10 g/mol.
Where can I buy Ethyl 2-cyano-2-[4-(2-ethoxy-2-oxoethyl)-3-phenyl-1,3-thiazol-2-ylidene]acetate?
You can request a quote for Ethyl 2-cyano-2-[4-(2-ethoxy-2-oxoethyl)-3-phenyl-1,3-thiazol-2-ylidene]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-cyano-2-[4-(2-ethoxy-2-oxoethyl)-3-phenyl-1,3-thiazol-2-ylidene]acetate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 2-cyano-2-[4-(2-ethoxy-2-oxoethyl)-3-phenyl-1,3-thiazol-2-ylidene]acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.