![ethyl 2-[(3-chlorophenyl)amino]-3,3,3-trifluoro-N-[(4-methoxyphenyl)carbonyl]alaninate structure](/static/products/354/354536-45-1.png)
ethyl 2-[(3-chlorophenyl)amino]-3,3,3-trifluoro-N-[(4-methoxyphenyl)carbonyl]alaninate
TL;DR: ethyl 2-[(3-chlorophenyl)amino]-3,3,3-trifluoro-N-[(4-methoxyphenyl)carbonyl]alaninate (CAS 354536-45-1) is a chemical compound with molecular formula C19H18ClF3N2O4 and molecular weight 430.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-(3-chloroanilino)-3,3,3-trifluoro-2-[(4-methoxybenzoyl)amino]propanoate
Also Known As: ethyl 2-[(3-chlorophenyl)amino]-3,3,3-trifluoro-N-[(4-methoxyphenyl)carbonyl]alaninate, (S)-ethyl 2-((3-chlorophenyl)amino)-3,3,3-trifluoro-2-(4-methoxybenzamido)propanoate, ethyl 2-(3-chloroanilino)-3,3,3-trifluoro-2-[(4-methoxybenzoyl)amino]propanoate, ethyl 2-[(3-chlorophenyl)amino]-3,3,3-trifluoro-2-[(4-methoxyphenyl)carbonylam ino]propanoate, ETHYL 2-[(3-CHLOROPHENYL)AMINO]-3,3,3-TRIFLUORO-2-[(4-METHOXYPHENYL)FORMAMIDO]PROPANOATE
| Molecular Formula | C19H18ClF3N2O4 |
|---|---|
| Molecular Weight | 430.09 g/mol |
| LogP | 4.0122 |
| Topological Polar Surface Area | 76.66 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 430.09073 |
| Heavy Atoms | 29 |
| Complexity | 874.5031 |
Chemical Identifiers
| CAS Number | 354536-45-1 |
|---|---|
| SMILES | CCOC(=O)C(C(F)(F)F)(NC1=CC(=CC=C1)Cl)NC(=O)C2=CC=C(C=C2)OC |
Product Overview
ethyl 2-[(3-chlorophenyl)amino]-3,3,3-trifluoro-N-[(4-methoxyphenyl)carbonyl]alaninate (CAS 354536-45-1), with molecular formula C19H18ClF3N2O4 and molecular weight 430.09 g/mol. IUPAC: ethyl 2-(3-chloroanilino)-3,3,3-trifluoro-2-[(4-methoxybenzoyl)amino]propanoate.
Chemical Property Profile of ethyl 2-[(3-chlorophenyl)amino]-3,3,3-trifluoro-N-[(4-methoxyphenyl)carbonyl]alaninate
Property Insights of ethyl 2-[(3-chlorophenyl)amino]-3,3,3-trifluoro-N-[(4-methoxyphenyl)carbonyl]alaninate
The XLogP value of 4.0122 indicates that ethyl 2-[(3-chlorophenyl)amino]-3,3,3-trifluoro-N-[(4-methoxyphenyl)carbonyl]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 2-[(3-chlorophenyl)amino]-3,3,3-trifluoro-N-[(4-methoxyphenyl)carbonyl]alaninate. Following Lipinski's Rule of Five, ethyl 2-[(3-chlorophenyl)amino]-3,3,3-trifluoro-N-[(4-methoxyphenyl)carbonyl]alaninate has 2 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 ethyl 2-[(3-chlorophenyl)amino]-3,3,3-trifluoro-N-[(4-methoxyphenyl)carbonyl]alaninate?
The CAS number of ethyl 2-[(3-chlorophenyl)amino]-3,3,3-trifluoro-N-[(4-methoxyphenyl)carbonyl]alaninate is 354536-45-1.
What is the molecular formula of ethyl 2-[(3-chlorophenyl)amino]-3,3,3-trifluoro-N-[(4-methoxyphenyl)carbonyl]alaninate?
The molecular formula of ethyl 2-[(3-chlorophenyl)amino]-3,3,3-trifluoro-N-[(4-methoxyphenyl)carbonyl]alaninate is C19H18ClF3N2O4.
What is the molecular weight of ethyl 2-[(3-chlorophenyl)amino]-3,3,3-trifluoro-N-[(4-methoxyphenyl)carbonyl]alaninate?
The molecular weight of ethyl 2-[(3-chlorophenyl)amino]-3,3,3-trifluoro-N-[(4-methoxyphenyl)carbonyl]alaninate is 430.09 g/mol.
Where can I buy ethyl 2-[(3-chlorophenyl)amino]-3,3,3-trifluoro-N-[(4-methoxyphenyl)carbonyl]alaninate?
You can request a quote for ethyl 2-[(3-chlorophenyl)amino]-3,3,3-trifluoro-N-[(4-methoxyphenyl)carbonyl]alaninate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ethyl 2-[(3-chlorophenyl)amino]-3,3,3-trifluoro-N-[(4-methoxyphenyl)carbonyl]alaninate?
Yes, KEHONG BIO provides custom synthesis services for ethyl 2-[(3-chlorophenyl)amino]-3,3,3-trifluoro-N-[(4-methoxyphenyl)carbonyl]alaninate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.