![Ethyl 2-[(3-chlorobenzoyl)amino]-3,3,3-trifluoro-2-(3-methylanilino)propanoate structure](/static/products/327/327100-89-0.png)
Ethyl 2-[(3-chlorobenzoyl)amino]-3,3,3-trifluoro-2-(3-methylanilino)propanoate
TL;DR: Ethyl 2-[(3-chlorobenzoyl)amino]-3,3,3-trifluoro-2-(3-methylanilino)propanoate (CAS 327100-89-0) is a chemical compound with molecular formula C19H18ClF3N2O3 and molecular weight 414.10 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-(3-methylanilino)propanoate
Also Known As: NCI60_030477, ethyl 2-[(3-chlorobenzoyl)amino]-3,3,3-trifluoro-2-(3-methylanilino)propanoate, Ethyl 2-(3-chlorobenzamido)-3,3,3-trifluoro-2-(m-toluidino)propionate, ethyl 2-(3-chlorobenzamido)-3,3,3-trifluoro-2-(m-tolylamino)propanoate, Ethyl 2-((3-chlorobenzoyl)amino)-3,3,3-trifluoro-2-(3-toluidino)propanoate
| Molecular Formula | C19H18ClF3N2O3 |
|---|---|
| Molecular Weight | 414.10 g/mol |
| LogP | 5.8 |
| Topological Polar Surface Area | 67.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 414.0958 |
| Heavy Atoms | 28 |
| Complexity | 561.0 |
Chemical Identifiers
| CAS Number | 327100-89-0 |
|---|---|
| SMILES | CCOC(=O)C(C(F)(F)F)(NC1=CC=CC(=C1)C)NC(=O)C2=CC(=CC=C2)Cl |
| InChIKey | RSOOEDHQKJLZDR-UHFFFAOYSA-N |
Product Overview
Ethyl 2-[(3-chlorobenzoyl)amino]-3,3,3-trifluoro-2-(3-methylanilino)propanoate (CAS 327100-89-0), with molecular formula C19H18ClF3N2O3 and molecular weight 414.10 g/mol. IUPAC: ethyl 2-[(3-chlorobenzoyl)amino]-3,3,3-trifluoro-2-(3-methylanilino)propanoate.
Chemical Property Profile of Ethyl 2-[(3-chlorobenzoyl)amino]-3,3,3-trifluoro-2-(3-methylanilino)propanoate
Property Insights of Ethyl 2-[(3-chlorobenzoyl)amino]-3,3,3-trifluoro-2-(3-methylanilino)propanoate
The XLogP value of 5.8 indicates that Ethyl 2-[(3-chlorobenzoyl)amino]-3,3,3-trifluoro-2-(3-methylanilino)propanoate 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-[(3-chlorobenzoyl)amino]-3,3,3-trifluoro-2-(3-methylanilino)propanoate. Following Lipinski's Rule of Five, Ethyl 2-[(3-chlorobenzoyl)amino]-3,3,3-trifluoro-2-(3-methylanilino)propanoate has 2 hydrogen bond donor(s) and 7 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-[(3-chlorobenzoyl)amino]-3,3,3-trifluoro-2-(3-methylanilino)propanoate?
The CAS number of Ethyl 2-[(3-chlorobenzoyl)amino]-3,3,3-trifluoro-2-(3-methylanilino)propanoate is 327100-89-0.
What is the molecular formula of Ethyl 2-[(3-chlorobenzoyl)amino]-3,3,3-trifluoro-2-(3-methylanilino)propanoate?
The molecular formula of Ethyl 2-[(3-chlorobenzoyl)amino]-3,3,3-trifluoro-2-(3-methylanilino)propanoate is C19H18ClF3N2O3.
What is the molecular weight of Ethyl 2-[(3-chlorobenzoyl)amino]-3,3,3-trifluoro-2-(3-methylanilino)propanoate?
The molecular weight of Ethyl 2-[(3-chlorobenzoyl)amino]-3,3,3-trifluoro-2-(3-methylanilino)propanoate is 414.10 g/mol.
Where can I buy Ethyl 2-[(3-chlorobenzoyl)amino]-3,3,3-trifluoro-2-(3-methylanilino)propanoate?
You can request a quote for Ethyl 2-[(3-chlorobenzoyl)amino]-3,3,3-trifluoro-2-(3-methylanilino)propanoate 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-chlorobenzoyl)amino]-3,3,3-trifluoro-2-(3-methylanilino)propanoate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 2-[(3-chlorobenzoyl)amino]-3,3,3-trifluoro-2-(3-methylanilino)propanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.