![ethyl 4-(trifluoromethyl)-2-[2-(5,5,5-trifluoro-4-oxopentan-2-ylidene)hydrazinyl]-1,3-thiazole-5-carboxylate structure](/static/products/861/861209-55-4.png)
ethyl 4-(trifluoromethyl)-2-[2-(5,5,5-trifluoro-4-oxopentan-2-ylidene)hydrazinyl]-1,3-thiazole-5-carboxylate
TL;DR: ethyl 4-(trifluoromethyl)-2-[2-(5,5,5-trifluoro-4-oxopentan-2-ylidene)hydrazinyl]-1,3-thiazole-5-carboxylate (CAS 861209-55-4) is a chemical compound with molecular formula C12H11F6N3O3S and molecular weight 391.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-(trifluoromethyl)-2-[2-(5,5,5-trifluoro-4-oxopentan-2-ylidene)hydrazinyl]-1,3-thiazole-5-carboxylate
Also Known As: ethyl 4-(trifluoromethyl)-2-[2-(5,5,5-trifluoro-4-oxopentan-2-ylidene)hydrazinyl]-1,3-thiazole-5-carboxylate, ethyl 4-(trifluoromethyl)-2-{2-[(Z)-4,4,4-trifluoro-1-methyl-3-oxobutylidene]hydrazino}-1,3-thiazole-5-carboxylate
| Molecular Formula | C12H11F6N3O3S |
|---|---|
| Molecular Weight | 391.04 g/mol |
| LogP | 3.6479 |
| Topological Polar Surface Area | 80.65 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 391.04254 |
| Heavy Atoms | 25 |
| Complexity | 680.61597 |
Chemical Identifiers
| CAS Number | 861209-55-4 |
|---|---|
| SMILES | CCOC(=O)C1=C(N=C(S1)NN=C(C)CC(=O)C(F)(F)F)C(F)(F)F |
Product Overview
ethyl 4-(trifluoromethyl)-2-[2-(5,5,5-trifluoro-4-oxopentan-2-ylidene)hydrazinyl]-1,3-thiazole-5-carboxylate (CAS 861209-55-4), with molecular formula C12H11F6N3O3S and molecular weight 391.04 g/mol. IUPAC: ethyl 4-(trifluoromethyl)-2-[2-(5,5,5-trifluoro-4-oxopentan-2-ylidene)hydrazinyl]-1,3-thiazole-5-carboxylate.
Chemical Property Profile of ethyl 4-(trifluoromethyl)-2-[2-(5,5,5-trifluoro-4-oxopentan-2-ylidene)hydrazinyl]-1,3-thiazole-5-carboxylate
Property Insights of ethyl 4-(trifluoromethyl)-2-[2-(5,5,5-trifluoro-4-oxopentan-2-ylidene)hydrazinyl]-1,3-thiazole-5-carboxylate
The XLogP value of 3.6479 indicates that ethyl 4-(trifluoromethyl)-2-[2-(5,5,5-trifluoro-4-oxopentan-2-ylidene)hydrazinyl]-1,3-thiazole-5-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 80.65 Ų falls within the moderate polarity range, balancing permeability and solubility for ethyl 4-(trifluoromethyl)-2-[2-(5,5,5-trifluoro-4-oxopentan-2-ylidene)hydrazinyl]-1,3-thiazole-5-carboxylate. Following Lipinski's Rule of Five, ethyl 4-(trifluoromethyl)-2-[2-(5,5,5-trifluoro-4-oxopentan-2-ylidene)hydrazinyl]-1,3-thiazole-5-carboxylate has 1 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 4-(trifluoromethyl)-2-[2-(5,5,5-trifluoro-4-oxopentan-2-ylidene)hydrazinyl]-1,3-thiazole-5-carboxylate?
The CAS number of ethyl 4-(trifluoromethyl)-2-[2-(5,5,5-trifluoro-4-oxopentan-2-ylidene)hydrazinyl]-1,3-thiazole-5-carboxylate is 861209-55-4.
What is the molecular formula of ethyl 4-(trifluoromethyl)-2-[2-(5,5,5-trifluoro-4-oxopentan-2-ylidene)hydrazinyl]-1,3-thiazole-5-carboxylate?
The molecular formula of ethyl 4-(trifluoromethyl)-2-[2-(5,5,5-trifluoro-4-oxopentan-2-ylidene)hydrazinyl]-1,3-thiazole-5-carboxylate is C12H11F6N3O3S.
What is the molecular weight of ethyl 4-(trifluoromethyl)-2-[2-(5,5,5-trifluoro-4-oxopentan-2-ylidene)hydrazinyl]-1,3-thiazole-5-carboxylate?
The molecular weight of ethyl 4-(trifluoromethyl)-2-[2-(5,5,5-trifluoro-4-oxopentan-2-ylidene)hydrazinyl]-1,3-thiazole-5-carboxylate is 391.04 g/mol.
Where can I buy ethyl 4-(trifluoromethyl)-2-[2-(5,5,5-trifluoro-4-oxopentan-2-ylidene)hydrazinyl]-1,3-thiazole-5-carboxylate?
You can request a quote for ethyl 4-(trifluoromethyl)-2-[2-(5,5,5-trifluoro-4-oxopentan-2-ylidene)hydrazinyl]-1,3-thiazole-5-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ethyl 4-(trifluoromethyl)-2-[2-(5,5,5-trifluoro-4-oxopentan-2-ylidene)hydrazinyl]-1,3-thiazole-5-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for ethyl 4-(trifluoromethyl)-2-[2-(5,5,5-trifluoro-4-oxopentan-2-ylidene)hydrazinyl]-1,3-thiazole-5-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.