Ethyl 2-acetamido-3,3,3-trifluoro-2-[4-(trifluoromethyl)anilino]propionate
TL;DR: Ethyl 2-acetamido-3,3,3-trifluoro-2-[4-(trifluoromethyl)anilino]propionate (CAS 328270-16-2) is a chemical compound with molecular formula C14H14F6N2O3 and molecular weight 372.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-acetamido-3,3,3-trifluoro-2-[4-(trifluoromethyl)anilino]propanoate
Also Known As: ethyl N-acetyl-3,3,3-trifluoro-2-{[4-(trifluoromethyl)phenyl]amino}alaninate, ethyl 2-acetamido-3,3,3-trifluoro-2-[4-(trifluoromethyl)anilino]propanoate, Ethyl 2-acetamido-3,3,3-trifluoro-2-[4-(trifluoromethyl)anilino]propionate, Ethyl 2-(acetylamino)-3,3,3-trifluoro-2-[4-(trifluoromethyl)anilino]propanoate #, ethyl 2-acetamido-3,3,3-trifluoro-2-((4-(trifluoromethyl)phenyl)amino)propanoate
| Molecular Formula | C14H14F6N2O3 |
|---|---|
| Molecular Weight | 372.09 g/mol |
| LogP | 4.0 |
| Topological Polar Surface Area | 67.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 6 |
| Exact Mass | 372.09085 |
| Heavy Atoms | 25 |
| Complexity | 486.0 |
Chemical Identifiers
| CAS Number | 328270-16-2 |
|---|---|
| SMILES | CCOC(=O)C(C(F)(F)F)(NC1=CC=C(C=C1)C(F)(F)F)NC(=O)C |
| InChIKey | VMLZGPHAFBRGQG-UHFFFAOYSA-N |
Product Overview
Ethyl 2-acetamido-3,3,3-trifluoro-2-[4-(trifluoromethyl)anilino]propionate (CAS 328270-16-2), with molecular formula C14H14F6N2O3 and molecular weight 372.09 g/mol. IUPAC: ethyl 2-acetamido-3,3,3-trifluoro-2-[4-(trifluoromethyl)anilino]propanoate.
Chemical Property Profile of Ethyl 2-acetamido-3,3,3-trifluoro-2-[4-(trifluoromethyl)anilino]propionate
Property Insights of Ethyl 2-acetamido-3,3,3-trifluoro-2-[4-(trifluoromethyl)anilino]propionate
The XLogP value of 4.0 indicates that Ethyl 2-acetamido-3,3,3-trifluoro-2-[4-(trifluoromethyl)anilino]propionate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 67.4 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 2-acetamido-3,3,3-trifluoro-2-[4-(trifluoromethyl)anilino]propionate. Following Lipinski's Rule of Five, Ethyl 2-acetamido-3,3,3-trifluoro-2-[4-(trifluoromethyl)anilino]propionate has 2 hydrogen bond donor(s) and 10 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-acetamido-3,3,3-trifluoro-2-[4-(trifluoromethyl)anilino]propionate?
The CAS number of Ethyl 2-acetamido-3,3,3-trifluoro-2-[4-(trifluoromethyl)anilino]propionate is 328270-16-2.
What is the molecular formula of Ethyl 2-acetamido-3,3,3-trifluoro-2-[4-(trifluoromethyl)anilino]propionate?
The molecular formula of Ethyl 2-acetamido-3,3,3-trifluoro-2-[4-(trifluoromethyl)anilino]propionate is C14H14F6N2O3.
What is the molecular weight of Ethyl 2-acetamido-3,3,3-trifluoro-2-[4-(trifluoromethyl)anilino]propionate?
The molecular weight of Ethyl 2-acetamido-3,3,3-trifluoro-2-[4-(trifluoromethyl)anilino]propionate is 372.09 g/mol.
Where can I buy Ethyl 2-acetamido-3,3,3-trifluoro-2-[4-(trifluoromethyl)anilino]propionate?
You can request a quote for Ethyl 2-acetamido-3,3,3-trifluoro-2-[4-(trifluoromethyl)anilino]propionate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 2-acetamido-3,3,3-trifluoro-2-[4-(trifluoromethyl)anilino]propionate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 2-acetamido-3,3,3-trifluoro-2-[4-(trifluoromethyl)anilino]propionate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.