![ethyl N-[(2,4-difluorophenyl)carbamoyl]-3,3,3-trifluoro-2-(4-fluorophenoxy)alaninate structure](/static/products/304/304879-15-0.png)
ethyl N-[(2,4-difluorophenyl)carbamoyl]-3,3,3-trifluoro-2-(4-fluorophenoxy)alaninate
TL;DR: ethyl N-[(2,4-difluorophenyl)carbamoyl]-3,3,3-trifluoro-2-(4-fluorophenoxy)alaninate (CAS 304879-15-0) is a chemical compound with molecular formula C18H14F6N2O4 and molecular weight 436.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[(2,4-difluorophenyl)carbamoylamino]-3,3,3-trifluoro-2-(4-fluorophenoxy)propanoate
Also Known As: ethyl N-[(2,4-difluorophenyl)carbamoyl]-3,3,3-trifluoro-2-(4-fluorophenoxy)alaninate, ethyl 2-(3-(2,4-difluorophenyl)ureido)-3,3,3-trifluoro-2-(4-fluorophenoxy)propanoate, ethyl 2-[(2,4-difluorophenyl)carbamoylamino]-3,3,3-trifluoro-2-(4-fluorophenoxy)propanoate, 2-[3-(2,4-Difluoro-phenyl)-ureido]-3,3,3-trifluoro-2-(4-fluoro-phenoxy)-propionic acid ethyl ester
| Molecular Formula | C18H14F6N2O4 |
|---|---|
| Molecular Weight | 436.09 g/mol |
| LogP | 4.1261 |
| Topological Polar Surface Area | 76.66 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 436.0858 |
| Heavy Atoms | 30 |
| Complexity | 919.8829 |
Chemical Identifiers
| CAS Number | 304879-15-0 |
|---|---|
| SMILES | CCOC(=O)C(C(F)(F)F)(NC(=O)NC1=C(C=C(C=C1)F)F)OC2=CC=C(C=C2)F |
Product Overview
ethyl N-[(2,4-difluorophenyl)carbamoyl]-3,3,3-trifluoro-2-(4-fluorophenoxy)alaninate (CAS 304879-15-0), with molecular formula C18H14F6N2O4 and molecular weight 436.09 g/mol. IUPAC: ethyl 2-[(2,4-difluorophenyl)carbamoylamino]-3,3,3-trifluoro-2-(4-fluorophenoxy)propanoate.
Chemical Property Profile of ethyl N-[(2,4-difluorophenyl)carbamoyl]-3,3,3-trifluoro-2-(4-fluorophenoxy)alaninate
Property Insights of ethyl N-[(2,4-difluorophenyl)carbamoyl]-3,3,3-trifluoro-2-(4-fluorophenoxy)alaninate
The XLogP value of 4.1261 indicates that ethyl N-[(2,4-difluorophenyl)carbamoyl]-3,3,3-trifluoro-2-(4-fluorophenoxy)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 N-[(2,4-difluorophenyl)carbamoyl]-3,3,3-trifluoro-2-(4-fluorophenoxy)alaninate. Following Lipinski's Rule of Five, ethyl N-[(2,4-difluorophenyl)carbamoyl]-3,3,3-trifluoro-2-(4-fluorophenoxy)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 N-[(2,4-difluorophenyl)carbamoyl]-3,3,3-trifluoro-2-(4-fluorophenoxy)alaninate?
The CAS number of ethyl N-[(2,4-difluorophenyl)carbamoyl]-3,3,3-trifluoro-2-(4-fluorophenoxy)alaninate is 304879-15-0.
What is the molecular formula of ethyl N-[(2,4-difluorophenyl)carbamoyl]-3,3,3-trifluoro-2-(4-fluorophenoxy)alaninate?
The molecular formula of ethyl N-[(2,4-difluorophenyl)carbamoyl]-3,3,3-trifluoro-2-(4-fluorophenoxy)alaninate is C18H14F6N2O4.
What is the molecular weight of ethyl N-[(2,4-difluorophenyl)carbamoyl]-3,3,3-trifluoro-2-(4-fluorophenoxy)alaninate?
The molecular weight of ethyl N-[(2,4-difluorophenyl)carbamoyl]-3,3,3-trifluoro-2-(4-fluorophenoxy)alaninate is 436.09 g/mol.
Where can I buy ethyl N-[(2,4-difluorophenyl)carbamoyl]-3,3,3-trifluoro-2-(4-fluorophenoxy)alaninate?
You can request a quote for ethyl N-[(2,4-difluorophenyl)carbamoyl]-3,3,3-trifluoro-2-(4-fluorophenoxy)alaninate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ethyl N-[(2,4-difluorophenyl)carbamoyl]-3,3,3-trifluoro-2-(4-fluorophenoxy)alaninate?
Yes, KEHONG BIO provides custom synthesis services for ethyl N-[(2,4-difluorophenyl)carbamoyl]-3,3,3-trifluoro-2-(4-fluorophenoxy)alaninate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.