![[2-[4-chloro-3-(trifluoromethyl)anilino]-2-oxo-1-phenylethyl] 2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetate structure](/static/products/853/853700-58-0.png)
[2-[4-chloro-3-(trifluoromethyl)anilino]-2-oxo-1-phenylethyl] 2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetate
TL;DR: [2-[4-chloro-3-(trifluoromethyl)anilino]-2-oxo-1-phenylethyl] 2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetate (CAS 853700-58-0) is a chemical compound with molecular formula C21H16ClF3N2O4S and molecular weight 484.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-[4-chloro-3-(trifluoromethyl)anilino]-2-oxo-1-phenylethyl] 2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetate
Also Known As: [2-[4-chloro-3-(trifluoromethyl)anilino]-2-oxo-1-phenylethyl] 2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetate|2-((4-Chloro-3-(trifluoromethyl)phenyl)amino)-2-oxo-1-phenylethyl 2-(4-methyl-2-oxothiazol-3(2H)-yl)acetate
| Molecular Formula | C21H16ClF3N2O4S |
|---|---|
| Molecular Weight | 484.05 g/mol |
| LogP | 4.81362 |
| Topological Polar Surface Area | 77.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 484.04715 |
| Heavy Atoms | 32 |
| Complexity | 1191.7457 |
Chemical Identifiers
| CAS Number | 853700-58-0 |
|---|---|
| SMILES | CC1=CSC(=O)N1CC(=O)OC(C2=CC=CC=C2)C(=O)NC3=CC(=C(C=C3)Cl)C(F)(F)F |
Product Overview
[2-[4-chloro-3-(trifluoromethyl)anilino]-2-oxo-1-phenylethyl] 2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetate (CAS 853700-58-0), with molecular formula C21H16ClF3N2O4S and molecular weight 484.05 g/mol. IUPAC: [2-[4-chloro-3-(trifluoromethyl)anilino]-2-oxo-1-phenylethyl] 2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetate.
Chemical Property Profile of [2-[4-chloro-3-(trifluoromethyl)anilino]-2-oxo-1-phenylethyl] 2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetate
Property Insights of [2-[4-chloro-3-(trifluoromethyl)anilino]-2-oxo-1-phenylethyl] 2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetate
The XLogP value of 4.81362 indicates that [2-[4-chloro-3-(trifluoromethyl)anilino]-2-oxo-1-phenylethyl] 2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 77.4 Ų falls within the moderate polarity range, balancing permeability and solubility for [2-[4-chloro-3-(trifluoromethyl)anilino]-2-oxo-1-phenylethyl] 2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetate. Following Lipinski's Rule of Five, [2-[4-chloro-3-(trifluoromethyl)anilino]-2-oxo-1-phenylethyl] 2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetate has 1 hydrogen bond donor(s) and 5 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 [2-[4-chloro-3-(trifluoromethyl)anilino]-2-oxo-1-phenylethyl] 2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetate?
The CAS number of [2-[4-chloro-3-(trifluoromethyl)anilino]-2-oxo-1-phenylethyl] 2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetate is 853700-58-0.
What is the molecular formula of [2-[4-chloro-3-(trifluoromethyl)anilino]-2-oxo-1-phenylethyl] 2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetate?
The molecular formula of [2-[4-chloro-3-(trifluoromethyl)anilino]-2-oxo-1-phenylethyl] 2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetate is C21H16ClF3N2O4S.
What is the molecular weight of [2-[4-chloro-3-(trifluoromethyl)anilino]-2-oxo-1-phenylethyl] 2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetate?
The molecular weight of [2-[4-chloro-3-(trifluoromethyl)anilino]-2-oxo-1-phenylethyl] 2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetate is 484.05 g/mol.
Where can I buy [2-[4-chloro-3-(trifluoromethyl)anilino]-2-oxo-1-phenylethyl] 2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetate?
You can request a quote for [2-[4-chloro-3-(trifluoromethyl)anilino]-2-oxo-1-phenylethyl] 2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [2-[4-chloro-3-(trifluoromethyl)anilino]-2-oxo-1-phenylethyl] 2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetate?
Yes, KEHONG BIO provides custom synthesis services for [2-[4-chloro-3-(trifluoromethyl)anilino]-2-oxo-1-phenylethyl] 2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.