![ethyl 3,3,3-trifluoro-2-(4-fluorophenoxy)-N-{[3-(trifluoromethyl)phenyl]carbamoyl}alaninate structure](/static/products/355/355146-39-3.png)
ethyl 3,3,3-trifluoro-2-(4-fluorophenoxy)-N-{[3-(trifluoromethyl)phenyl]carbamoyl}alaninate
TL;DR: ethyl 3,3,3-trifluoro-2-(4-fluorophenoxy)-N-{[3-(trifluoromethyl)phenyl]carbamoyl}alaninate (CAS 355146-39-3) is a chemical compound with molecular formula C19H15F7N2O4 and molecular weight 468.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 3,3,3-trifluoro-2-(4-fluorophenoxy)-2-[[3-(trifluoromethyl)phenyl]carbamoylamino]propanoate
Also Known As: ethyl 3,3,3-trifluoro-2-(4-fluorophenoxy)-N-{[3-(trifluoromethyl)phenyl]carbamoyl}alaninate, Ethyl 3,3,3-trifluoro-2-(4-fluorophenoxy)-2-[[3-(trifluoromethyl)phenyl]carbamoylamino]propanoate, ethyl 3,3,3-trifluoro-2-(4-fluorophenoxy)-2-(3-(3-(trifluoromethyl)phenyl)ureido)propanoate
| Molecular Formula | C19H15F7N2O4 |
|---|---|
| Molecular Weight | 468.09 g/mol |
| LogP | 4.8667 |
| Topological Polar Surface Area | 76.66 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 468.092 |
| Heavy Atoms | 32 |
| Complexity | 961.384 |
Chemical Identifiers
| CAS Number | 355146-39-3 |
|---|---|
| SMILES | CCOC(=O)C(C(F)(F)F)(NC(=O)NC1=CC=CC(=C1)C(F)(F)F)OC2=CC=C(C=C2)F |
Product Overview
ethyl 3,3,3-trifluoro-2-(4-fluorophenoxy)-N-{[3-(trifluoromethyl)phenyl]carbamoyl}alaninate (CAS 355146-39-3), with molecular formula C19H15F7N2O4 and molecular weight 468.09 g/mol. IUPAC: ethyl 3,3,3-trifluoro-2-(4-fluorophenoxy)-2-[[3-(trifluoromethyl)phenyl]carbamoylamino]propanoate.
Chemical Property Profile of ethyl 3,3,3-trifluoro-2-(4-fluorophenoxy)-N-{[3-(trifluoromethyl)phenyl]carbamoyl}alaninate
Property Insights of ethyl 3,3,3-trifluoro-2-(4-fluorophenoxy)-N-{[3-(trifluoromethyl)phenyl]carbamoyl}alaninate
The XLogP value of 4.8667 indicates that ethyl 3,3,3-trifluoro-2-(4-fluorophenoxy)-N-{[3-(trifluoromethyl)phenyl]carbamoyl}alaninate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 76.66 Ų falls within the moderate polarity range, balancing permeability and solubility for ethyl 3,3,3-trifluoro-2-(4-fluorophenoxy)-N-{[3-(trifluoromethyl)phenyl]carbamoyl}alaninate. Following Lipinski's Rule of Five, ethyl 3,3,3-trifluoro-2-(4-fluorophenoxy)-N-{[3-(trifluoromethyl)phenyl]carbamoyl}alaninate has 2 hydrogen bond donor(s) and 4 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 3,3,3-trifluoro-2-(4-fluorophenoxy)-N-{[3-(trifluoromethyl)phenyl]carbamoyl}alaninate?
The CAS number of ethyl 3,3,3-trifluoro-2-(4-fluorophenoxy)-N-{[3-(trifluoromethyl)phenyl]carbamoyl}alaninate is 355146-39-3.
What is the molecular formula of ethyl 3,3,3-trifluoro-2-(4-fluorophenoxy)-N-{[3-(trifluoromethyl)phenyl]carbamoyl}alaninate?
The molecular formula of ethyl 3,3,3-trifluoro-2-(4-fluorophenoxy)-N-{[3-(trifluoromethyl)phenyl]carbamoyl}alaninate is C19H15F7N2O4.
What is the molecular weight of ethyl 3,3,3-trifluoro-2-(4-fluorophenoxy)-N-{[3-(trifluoromethyl)phenyl]carbamoyl}alaninate?
The molecular weight of ethyl 3,3,3-trifluoro-2-(4-fluorophenoxy)-N-{[3-(trifluoromethyl)phenyl]carbamoyl}alaninate is 468.09 g/mol.
Where can I buy ethyl 3,3,3-trifluoro-2-(4-fluorophenoxy)-N-{[3-(trifluoromethyl)phenyl]carbamoyl}alaninate?
You can request a quote for ethyl 3,3,3-trifluoro-2-(4-fluorophenoxy)-N-{[3-(trifluoromethyl)phenyl]carbamoyl}alaninate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ethyl 3,3,3-trifluoro-2-(4-fluorophenoxy)-N-{[3-(trifluoromethyl)phenyl]carbamoyl}alaninate?
Yes, KEHONG BIO provides custom synthesis services for ethyl 3,3,3-trifluoro-2-(4-fluorophenoxy)-N-{[3-(trifluoromethyl)phenyl]carbamoyl}alaninate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.