![(Z)-ethyl 2-((2-cyano-2-(4-(3-oxo-3H-benzo[f]chromen-2-yl)thiazol-2-yl)vinyl)amino)-4,5-dimethylthiophene-3-carboxylate structure](/static/products/843/843631-44-7.png)
(Z)-ethyl 2-((2-cyano-2-(4-(3-oxo-3H-benzo[f]chromen-2-yl)thiazol-2-yl)vinyl)amino)-4,5-dimethylthiophene-3-carboxylate
TL;DR: (Z)-ethyl 2-((2-cyano-2-(4-(3-oxo-3H-benzo[f]chromen-2-yl)thiazol-2-yl)vinyl)amino)-4,5-dimethylthiophene-3-carboxylate (CAS 843631-44-7) is a chemical compound with molecular formula C28H21N3O4S2 and molecular weight 527.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[[(Z)-2-cyano-2-[4-(3-oxobenzo[f]chromen-2-yl)-1,3-thiazol-2-yl]ethenyl]amino]-4,5-dimethylthiophene-3-carboxylate
Also Known As: (Z)-ethyl 2-((2-cyano-2-(4-(3-oxo-3H-benzo[f]chromen-2-yl)thiazol-2-yl)vinyl)amino)-4,5-dimethylthiophene-3-carboxylate, ethyl 2-({(Z)-2-cyano-2-[4-(3-oxo-3H-benzo[f]chromen-2-yl)-1,3-thiazol-2-yl]ethenyl}amino)-4,5-dimethylthiophene-3-carboxylate, ethyl 2-[[(Z)-2-cyano-2-[4-(3-oxobenzo[f]chromen-2-yl)-1,3-thiazol-2-yl]ethenyl]amino]-4,5-dimethylthiophene-3-carboxylate
| Molecular Formula | C28H21N3O4S2 |
|---|---|
| Molecular Weight | 527.10 g/mol |
| LogP | 6.90132 |
| Topological Polar Surface Area | 105.22 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 6 |
| Exact Mass | 527.09735 |
| Heavy Atoms | 37 |
| Complexity | 1804.104 |
Chemical Identifiers
| CAS Number | 843631-44-7 |
|---|---|
| SMILES | CCOC(=O)C1=C(SC(=C1C)C)N/C=C(/C#N)\C2=NC(=CS2)C3=CC4=C(C=CC5=CC=CC=C54)OC3=O |
Product Overview
(Z)-ethyl 2-((2-cyano-2-(4-(3-oxo-3H-benzo[f]chromen-2-yl)thiazol-2-yl)vinyl)amino)-4,5-dimethylthiophene-3-carboxylate (CAS 843631-44-7), with molecular formula C28H21N3O4S2 and molecular weight 527.10 g/mol. IUPAC: ethyl 2-[[(Z)-2-cyano-2-[4-(3-oxobenzo[f]chromen-2-yl)-1,3-thiazol-2-yl]ethenyl]amino]-4,5-dimethylthiophene-3-carboxylate.
Chemical Property Profile of (Z)-ethyl 2-((2-cyano-2-(4-(3-oxo-3H-benzo[f]chromen-2-yl)thiazol-2-yl)vinyl)amino)-4,5-dimethylthiophene-3-carboxylate
Property Insights of (Z)-ethyl 2-((2-cyano-2-(4-(3-oxo-3H-benzo[f]chromen-2-yl)thiazol-2-yl)vinyl)amino)-4,5-dimethylthiophene-3-carboxylate
The XLogP value of 6.90132 indicates that (Z)-ethyl 2-((2-cyano-2-(4-(3-oxo-3H-benzo[f]chromen-2-yl)thiazol-2-yl)vinyl)amino)-4,5-dimethylthiophene-3-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 105.22 Ų falls within the moderate polarity range, balancing permeability and solubility for (Z)-ethyl 2-((2-cyano-2-(4-(3-oxo-3H-benzo[f]chromen-2-yl)thiazol-2-yl)vinyl)amino)-4,5-dimethylthiophene-3-carboxylate. Following Lipinski's Rule of Five, (Z)-ethyl 2-((2-cyano-2-(4-(3-oxo-3H-benzo[f]chromen-2-yl)thiazol-2-yl)vinyl)amino)-4,5-dimethylthiophene-3-carboxylate has 1 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (Z)-ethyl 2-((2-cyano-2-(4-(3-oxo-3H-benzo[f]chromen-2-yl)thiazol-2-yl)vinyl)amino)-4,5-dimethylthiophene-3-carboxylate?
The CAS number of (Z)-ethyl 2-((2-cyano-2-(4-(3-oxo-3H-benzo[f]chromen-2-yl)thiazol-2-yl)vinyl)amino)-4,5-dimethylthiophene-3-carboxylate is 843631-44-7.
What is the molecular formula of (Z)-ethyl 2-((2-cyano-2-(4-(3-oxo-3H-benzo[f]chromen-2-yl)thiazol-2-yl)vinyl)amino)-4,5-dimethylthiophene-3-carboxylate?
The molecular formula of (Z)-ethyl 2-((2-cyano-2-(4-(3-oxo-3H-benzo[f]chromen-2-yl)thiazol-2-yl)vinyl)amino)-4,5-dimethylthiophene-3-carboxylate is C28H21N3O4S2.
What is the molecular weight of (Z)-ethyl 2-((2-cyano-2-(4-(3-oxo-3H-benzo[f]chromen-2-yl)thiazol-2-yl)vinyl)amino)-4,5-dimethylthiophene-3-carboxylate?
The molecular weight of (Z)-ethyl 2-((2-cyano-2-(4-(3-oxo-3H-benzo[f]chromen-2-yl)thiazol-2-yl)vinyl)amino)-4,5-dimethylthiophene-3-carboxylate is 527.10 g/mol.
Where can I buy (Z)-ethyl 2-((2-cyano-2-(4-(3-oxo-3H-benzo[f]chromen-2-yl)thiazol-2-yl)vinyl)amino)-4,5-dimethylthiophene-3-carboxylate?
You can request a quote for (Z)-ethyl 2-((2-cyano-2-(4-(3-oxo-3H-benzo[f]chromen-2-yl)thiazol-2-yl)vinyl)amino)-4,5-dimethylthiophene-3-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (Z)-ethyl 2-((2-cyano-2-(4-(3-oxo-3H-benzo[f]chromen-2-yl)thiazol-2-yl)vinyl)amino)-4,5-dimethylthiophene-3-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for (Z)-ethyl 2-((2-cyano-2-(4-(3-oxo-3H-benzo[f]chromen-2-yl)thiazol-2-yl)vinyl)amino)-4,5-dimethylthiophene-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.