(E)-ethyl 3,3,3-trifluoro-2-(4-((4-fluorobenzylidene)amino)-3-methoxyphenyl)-2-hydroxypropanoate
TL;DR: (E)-ethyl 3,3,3-trifluoro-2-(4-((4-fluorobenzylidene)amino)-3-methoxyphenyl)-2-hydroxypropanoate (CAS 256333-10-5) 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-[(4-fluorophenyl)methylideneamino]-3-methoxyphenyl]-2-hydroxypropanoate
Also Known As: (E)-ethyl 3,3,3-trifluoro-2-(4-((4-fluorobenzylidene)amino)-3-methoxyphenyl)-2-hydroxypropanoate, ethyl 3,3,3-trifluoro-2-(4-{[(E)-(4-fluorophenyl)methylidene]amino}-3-methoxyphenyl)-2-hydroxypropanoate, ethyl 3,3,3-trifluoro-2-[4-[(4-fluorophenyl)methylideneamino]-3-methoxyphenyl]-2-hydroxypropanoate
| Molecular Formula | C19H17F4NO4 |
|---|---|
| Molecular Weight | 399.11 g/mol |
| LogP | 3.8979 |
| Topological Polar Surface Area | 68.12 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 399.10938 |
| Heavy Atoms | 28 |
| Complexity | 865.2276 |
Chemical Identifiers
| CAS Number | 256333-10-5 |
|---|---|
| SMILES | CCOC(=O)C(C1=CC(=C(C=C1)N=CC2=CC=C(C=C2)F)OC)(C(F)(F)F)O |
Product Overview
(E)-ethyl 3,3,3-trifluoro-2-(4-((4-fluorobenzylidene)amino)-3-methoxyphenyl)-2-hydroxypropanoate (CAS 256333-10-5), with molecular formula C19H17F4NO4 and molecular weight 399.11 g/mol. IUPAC: ethyl 3,3,3-trifluoro-2-[4-[(4-fluorophenyl)methylideneamino]-3-methoxyphenyl]-2-hydroxypropanoate.
Chemical Property Profile of (E)-ethyl 3,3,3-trifluoro-2-(4-((4-fluorobenzylidene)amino)-3-methoxyphenyl)-2-hydroxypropanoate
Property Insights of (E)-ethyl 3,3,3-trifluoro-2-(4-((4-fluorobenzylidene)amino)-3-methoxyphenyl)-2-hydroxypropanoate
The XLogP value of 3.8979 indicates that (E)-ethyl 3,3,3-trifluoro-2-(4-((4-fluorobenzylidene)amino)-3-methoxyphenyl)-2-hydroxypropanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 68.12 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-ethyl 3,3,3-trifluoro-2-(4-((4-fluorobenzylidene)amino)-3-methoxyphenyl)-2-hydroxypropanoate. Following Lipinski's Rule of Five, (E)-ethyl 3,3,3-trifluoro-2-(4-((4-fluorobenzylidene)amino)-3-methoxyphenyl)-2-hydroxypropanoate has 1 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 (E)-ethyl 3,3,3-trifluoro-2-(4-((4-fluorobenzylidene)amino)-3-methoxyphenyl)-2-hydroxypropanoate?
The CAS number of (E)-ethyl 3,3,3-trifluoro-2-(4-((4-fluorobenzylidene)amino)-3-methoxyphenyl)-2-hydroxypropanoate is 256333-10-5.
What is the molecular formula of (E)-ethyl 3,3,3-trifluoro-2-(4-((4-fluorobenzylidene)amino)-3-methoxyphenyl)-2-hydroxypropanoate?
The molecular formula of (E)-ethyl 3,3,3-trifluoro-2-(4-((4-fluorobenzylidene)amino)-3-methoxyphenyl)-2-hydroxypropanoate is C19H17F4NO4.
What is the molecular weight of (E)-ethyl 3,3,3-trifluoro-2-(4-((4-fluorobenzylidene)amino)-3-methoxyphenyl)-2-hydroxypropanoate?
The molecular weight of (E)-ethyl 3,3,3-trifluoro-2-(4-((4-fluorobenzylidene)amino)-3-methoxyphenyl)-2-hydroxypropanoate is 399.11 g/mol.
Where can I buy (E)-ethyl 3,3,3-trifluoro-2-(4-((4-fluorobenzylidene)amino)-3-methoxyphenyl)-2-hydroxypropanoate?
You can request a quote for (E)-ethyl 3,3,3-trifluoro-2-(4-((4-fluorobenzylidene)amino)-3-methoxyphenyl)-2-hydroxypropanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-ethyl 3,3,3-trifluoro-2-(4-((4-fluorobenzylidene)amino)-3-methoxyphenyl)-2-hydroxypropanoate?
Yes, KEHONG BIO provides custom synthesis services for (E)-ethyl 3,3,3-trifluoro-2-(4-((4-fluorobenzylidene)amino)-3-methoxyphenyl)-2-hydroxypropanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.