![ethyl 2-[(2-chlorobenzyl)amino]-3,3,3-trifluoro-N-(phenylcarbonyl)alaninate structure](/static/products/355/355156-39-7.png)
ethyl 2-[(2-chlorobenzyl)amino]-3,3,3-trifluoro-N-(phenylcarbonyl)alaninate
TL;DR: ethyl 2-[(2-chlorobenzyl)amino]-3,3,3-trifluoro-N-(phenylcarbonyl)alaninate (CAS 355156-39-7) 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-benzamido-2-[(2-chlorophenyl)methylamino]-3,3,3-trifluoropropanoate
Also Known As: ethyl 2-[(2-chlorobenzyl)amino]-3,3,3-trifluoro-N-(phenylcarbonyl)alaninate, ethyl 2-benzamido-2-((2-chlorobenzyl)amino)-3,3,3-trifluoropropanoate, ethyl 2-{[(2-chlorophenyl)methyl]amino}-3,3,3-trifluoro-2-(phenylcarbonylamino )propanoate, Ethyl 2-benzamido-2-[(2-chlorophenyl)methylamino]-3,3,3-trifluoro-propanoate, ethyl 2-benzamido-2-[(2-chlorophenyl)methylamino]-3,3,3-trifluoropropanoate
| Molecular Formula | C19H18ClF3N2O3 |
|---|---|
| Molecular Weight | 414.10 g/mol |
| LogP | 3.6813 |
| Topological Polar Surface Area | 67.43 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 414.0958 |
| Heavy Atoms | 28 |
| Complexity | 830.6736 |
Chemical Identifiers
| CAS Number | 355156-39-7 |
|---|---|
| SMILES | CCOC(=O)C(C(F)(F)F)(NCC1=CC=CC=C1Cl)NC(=O)C2=CC=CC=C2 |
Product Overview
ethyl 2-[(2-chlorobenzyl)amino]-3,3,3-trifluoro-N-(phenylcarbonyl)alaninate (CAS 355156-39-7), with molecular formula C19H18ClF3N2O3 and molecular weight 414.10 g/mol. IUPAC: ethyl 2-benzamido-2-[(2-chlorophenyl)methylamino]-3,3,3-trifluoropropanoate.
Chemical Property Profile of ethyl 2-[(2-chlorobenzyl)amino]-3,3,3-trifluoro-N-(phenylcarbonyl)alaninate
Property Insights of ethyl 2-[(2-chlorobenzyl)amino]-3,3,3-trifluoro-N-(phenylcarbonyl)alaninate
The XLogP value of 3.6813 indicates that ethyl 2-[(2-chlorobenzyl)amino]-3,3,3-trifluoro-N-(phenylcarbonyl)alaninate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 67.43 Ų falls within the moderate polarity range, balancing permeability and solubility for ethyl 2-[(2-chlorobenzyl)amino]-3,3,3-trifluoro-N-(phenylcarbonyl)alaninate. Following Lipinski's Rule of Five, ethyl 2-[(2-chlorobenzyl)amino]-3,3,3-trifluoro-N-(phenylcarbonyl)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 2-[(2-chlorobenzyl)amino]-3,3,3-trifluoro-N-(phenylcarbonyl)alaninate?
The CAS number of ethyl 2-[(2-chlorobenzyl)amino]-3,3,3-trifluoro-N-(phenylcarbonyl)alaninate is 355156-39-7.
What is the molecular formula of ethyl 2-[(2-chlorobenzyl)amino]-3,3,3-trifluoro-N-(phenylcarbonyl)alaninate?
The molecular formula of ethyl 2-[(2-chlorobenzyl)amino]-3,3,3-trifluoro-N-(phenylcarbonyl)alaninate is C19H18ClF3N2O3.
What is the molecular weight of ethyl 2-[(2-chlorobenzyl)amino]-3,3,3-trifluoro-N-(phenylcarbonyl)alaninate?
The molecular weight of ethyl 2-[(2-chlorobenzyl)amino]-3,3,3-trifluoro-N-(phenylcarbonyl)alaninate is 414.10 g/mol.
Where can I buy ethyl 2-[(2-chlorobenzyl)amino]-3,3,3-trifluoro-N-(phenylcarbonyl)alaninate?
You can request a quote for ethyl 2-[(2-chlorobenzyl)amino]-3,3,3-trifluoro-N-(phenylcarbonyl)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-[(2-chlorobenzyl)amino]-3,3,3-trifluoro-N-(phenylcarbonyl)alaninate?
Yes, KEHONG BIO provides custom synthesis services for ethyl 2-[(2-chlorobenzyl)amino]-3,3,3-trifluoro-N-(phenylcarbonyl)alaninate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.