ethyl 3,3,3-trifluoro-2-(4-(3-fluoro-N-methylbenzamido)phenyl)-2-hydroxypropanoate
TL;DR: ethyl 3,3,3-trifluoro-2-(4-(3-fluoro-N-methylbenzamido)phenyl)-2-hydroxypropanoate (CAS 317844-49-8) is a chemical compound with molecular formula C19H17F4NO4 and molecular weight 399.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 3,3,3-trifluoro-2-[4-[(3-fluorobenzoyl)-methylamino]phenyl]-2-hydroxypropanoate
Also Known As: ethyl 3,3,3-trifluoro-2-(4-(3-fluoro-N-methylbenzamido)phenyl)-2-hydroxypropanoate, ethyl 3,3,3-trifluoro-2-[4-[(3-fluorobenzoyl)-methylamino]phenyl]-2-hydroxypropanoate, ethyl 3,3,3-trifluoro-2-{4-[(3-fluorobenzoyl)(methyl)amino]phenyl}-2-hydroxypropanoate, ethyl 3,3,3-trifluoro-2-(4-{[(3-fluorophenyl)carbonyl](methyl)amino}phenyl)-2-hydroxypropanoate
| Molecular Formula | C19H17F4NO4 |
|---|---|
| Molecular Weight | 399.11 g/mol |
| LogP | 3.4153 |
| Topological Polar Surface Area | 66.84 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 399.10938 |
| Heavy Atoms | 28 |
| Complexity | 866.9825 |
Chemical Identifiers
| CAS Number | 317844-49-8 |
|---|---|
| SMILES | CCOC(=O)C(C1=CC=C(C=C1)N(C)C(=O)C2=CC(=CC=C2)F)(C(F)(F)F)O |
Product Overview
ethyl 3,3,3-trifluoro-2-(4-(3-fluoro-N-methylbenzamido)phenyl)-2-hydroxypropanoate (CAS 317844-49-8), with molecular formula C19H17F4NO4 and molecular weight 399.11 g/mol. IUPAC: ethyl 3,3,3-trifluoro-2-[4-[(3-fluorobenzoyl)-methylamino]phenyl]-2-hydroxypropanoate.
Chemical Property Profile of ethyl 3,3,3-trifluoro-2-(4-(3-fluoro-N-methylbenzamido)phenyl)-2-hydroxypropanoate
Property Insights of ethyl 3,3,3-trifluoro-2-(4-(3-fluoro-N-methylbenzamido)phenyl)-2-hydroxypropanoate
The XLogP value of 3.4153 indicates that ethyl 3,3,3-trifluoro-2-(4-(3-fluoro-N-methylbenzamido)phenyl)-2-hydroxypropanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.84 Ų falls within the moderate polarity range, balancing permeability and solubility for ethyl 3,3,3-trifluoro-2-(4-(3-fluoro-N-methylbenzamido)phenyl)-2-hydroxypropanoate. Following Lipinski's Rule of Five, ethyl 3,3,3-trifluoro-2-(4-(3-fluoro-N-methylbenzamido)phenyl)-2-hydroxypropanoate has 1 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 3,3,3-trifluoro-2-(4-(3-fluoro-N-methylbenzamido)phenyl)-2-hydroxypropanoate?
The CAS number of ethyl 3,3,3-trifluoro-2-(4-(3-fluoro-N-methylbenzamido)phenyl)-2-hydroxypropanoate is 317844-49-8.
What is the molecular formula of ethyl 3,3,3-trifluoro-2-(4-(3-fluoro-N-methylbenzamido)phenyl)-2-hydroxypropanoate?
The molecular formula of ethyl 3,3,3-trifluoro-2-(4-(3-fluoro-N-methylbenzamido)phenyl)-2-hydroxypropanoate is C19H17F4NO4.
What is the molecular weight of ethyl 3,3,3-trifluoro-2-(4-(3-fluoro-N-methylbenzamido)phenyl)-2-hydroxypropanoate?
The molecular weight of ethyl 3,3,3-trifluoro-2-(4-(3-fluoro-N-methylbenzamido)phenyl)-2-hydroxypropanoate is 399.11 g/mol.
Where can I buy ethyl 3,3,3-trifluoro-2-(4-(3-fluoro-N-methylbenzamido)phenyl)-2-hydroxypropanoate?
You can request a quote for ethyl 3,3,3-trifluoro-2-(4-(3-fluoro-N-methylbenzamido)phenyl)-2-hydroxypropanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ethyl 3,3,3-trifluoro-2-(4-(3-fluoro-N-methylbenzamido)phenyl)-2-hydroxypropanoate?
Yes, KEHONG BIO provides custom synthesis services for ethyl 3,3,3-trifluoro-2-(4-(3-fluoro-N-methylbenzamido)phenyl)-2-hydroxypropanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.