Ethyl 2-(O-anisidino)-2-(3-chlorobenzamido)-3,3,3-trifluoropropionate
TL;DR: Ethyl 2-(O-anisidino)-2-(3-chlorobenzamido)-3,3,3-trifluoropropionate (CAS 327100-57-2) 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-chlorobenzoyl)amino]-3,3,3-trifluoro-2-(2-methoxyanilino)propanoate
Also Known As: Ethyl 2-(O-anisidino)-2-(3-chlorobenzamido)-3,3,3-trifluoropropionate, Ethyl 2-[(3-chlorobenzoyl)amino]-3,3,3-trifluoro-2-(2-methoxyanilino)propanoate, ethyl 2-(3-chlorobenzamido)-3,3,3-trifluoro-2-((2-methoxyphenyl)amino)propanoate, Ethyl 2-[(3-chlorobenzoyl)amino]-3,3,3-trifluoro-2-(2-methoxyanilino)propanoate #, ethyl N-[(3-chlorophenyl)carbonyl]-3,3,3-trifluoro-2-[(2-methoxyphenyl)amino]alaninate
| Molecular Formula | C19H18ClF3N2O4 |
|---|---|
| Molecular Weight | 430.09 g/mol |
| LogP | 5.4 |
| Topological Polar Surface Area | 76.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 8 |
| Exact Mass | 430.09073 |
| Heavy Atoms | 29 |
| Complexity | 578.0 |
Chemical Identifiers
| CAS Number | 327100-57-2 |
|---|---|
| SMILES | CCOC(=O)C(C(F)(F)F)(NC1=CC=CC=C1OC)NC(=O)C2=CC(=CC=C2)Cl |
| InChIKey | GBJFPNHQWALXFX-UHFFFAOYSA-N |
Product Overview
Ethyl 2-(O-anisidino)-2-(3-chlorobenzamido)-3,3,3-trifluoropropionate (CAS 327100-57-2), with molecular formula C19H18ClF3N2O4 and molecular weight 430.09 g/mol. IUPAC: ethyl 2-[(3-chlorobenzoyl)amino]-3,3,3-trifluoro-2-(2-methoxyanilino)propanoate.
Chemical Property Profile of Ethyl 2-(O-anisidino)-2-(3-chlorobenzamido)-3,3,3-trifluoropropionate
Property Insights of Ethyl 2-(O-anisidino)-2-(3-chlorobenzamido)-3,3,3-trifluoropropionate
The XLogP value of 5.4 indicates that Ethyl 2-(O-anisidino)-2-(3-chlorobenzamido)-3,3,3-trifluoropropionate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 76.7 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 2-(O-anisidino)-2-(3-chlorobenzamido)-3,3,3-trifluoropropionate. Following Lipinski's Rule of Five, Ethyl 2-(O-anisidino)-2-(3-chlorobenzamido)-3,3,3-trifluoropropionate has 2 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Ethyl 2-(O-anisidino)-2-(3-chlorobenzamido)-3,3,3-trifluoropropionate?
The CAS number of Ethyl 2-(O-anisidino)-2-(3-chlorobenzamido)-3,3,3-trifluoropropionate is 327100-57-2.
What is the molecular formula of Ethyl 2-(O-anisidino)-2-(3-chlorobenzamido)-3,3,3-trifluoropropionate?
The molecular formula of Ethyl 2-(O-anisidino)-2-(3-chlorobenzamido)-3,3,3-trifluoropropionate is C19H18ClF3N2O4.
What is the molecular weight of Ethyl 2-(O-anisidino)-2-(3-chlorobenzamido)-3,3,3-trifluoropropionate?
The molecular weight of Ethyl 2-(O-anisidino)-2-(3-chlorobenzamido)-3,3,3-trifluoropropionate is 430.09 g/mol.
Where can I buy Ethyl 2-(O-anisidino)-2-(3-chlorobenzamido)-3,3,3-trifluoropropionate?
You can request a quote for Ethyl 2-(O-anisidino)-2-(3-chlorobenzamido)-3,3,3-trifluoropropionate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 2-(O-anisidino)-2-(3-chlorobenzamido)-3,3,3-trifluoropropionate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 2-(O-anisidino)-2-(3-chlorobenzamido)-3,3,3-trifluoropropionate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.