(R,E)-methyl 3,3,3-trifluoro-2-hydroxy-2-(4-((2-hydroxybenzylidene)amino)-3-methylphenyl)propanoate
TL;DR: (R,E)-methyl 3,3,3-trifluoro-2-hydroxy-2-(4-((2-hydroxybenzylidene)amino)-3-methylphenyl)propanoate (CAS 355148-17-3) is a chemical compound with molecular formula C18H16F3NO4 and molecular weight 367.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 3,3,3-trifluoro-2-hydroxy-2-[4-[(2-hydroxyphenyl)methylideneamino]-3-methylphenyl]propanoate
Also Known As: (R,E)-methyl 3,3,3-trifluoro-2-hydroxy-2-(4-((2-hydroxybenzylidene)amino)-3-methylphenyl)propanoate, 3,3,3-Trifluoro-2-hydroxy-2-(4-{[1-(2-hydroxy-phenyl)-meth-(E)-ylidene]-amino}-3-methyl-phenyl)-propionic acid methyl ester, methyl 2-{4-[(1E)-2-(2-hydroxyphenyl)-1-azavinyl]-3-methylphenyl}-3,3,3-triflu oro-2-hydroxypropanoate, methyl 3,3,3-trifluoro-2-hydroxy-2-(4-{[(E)-(2-hydroxyphenyl)methylidene]amino}-3-methylphenyl)propanoate, methyl 3,3,3-trifluoro-2-hydroxy-2-[3-methyl-4-[(6-oxocyclohexa-2,4-dien-1-ylidene)methylamino]phenyl]propanoate
| Molecular Formula | C18H16F3NO4 |
|---|---|
| Molecular Weight | 367.10 g/mol |
| LogP | 3.37412 |
| Topological Polar Surface Area | 79.12 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 367.10315 |
| Heavy Atoms | 26 |
| Complexity | 848.5701 |
Chemical Identifiers
| CAS Number | 355148-17-3 |
|---|---|
| SMILES | CC1=C(C=CC(=C1)C(C(=O)OC)(C(F)(F)F)O)N=CC2=CC=CC=C2O |
Product Overview
(R,E)-methyl 3,3,3-trifluoro-2-hydroxy-2-(4-((2-hydroxybenzylidene)amino)-3-methylphenyl)propanoate (CAS 355148-17-3), with molecular formula C18H16F3NO4 and molecular weight 367.10 g/mol. IUPAC: methyl 3,3,3-trifluoro-2-hydroxy-2-[4-[(2-hydroxyphenyl)methylideneamino]-3-methylphenyl]propanoate.
Chemical Property Profile of (R,E)-methyl 3,3,3-trifluoro-2-hydroxy-2-(4-((2-hydroxybenzylidene)amino)-3-methylphenyl)propanoate
Property Insights of (R,E)-methyl 3,3,3-trifluoro-2-hydroxy-2-(4-((2-hydroxybenzylidene)amino)-3-methylphenyl)propanoate
The XLogP value of 3.37412 indicates that (R,E)-methyl 3,3,3-trifluoro-2-hydroxy-2-(4-((2-hydroxybenzylidene)amino)-3-methylphenyl)propanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 79.12 Ų falls within the moderate polarity range, balancing permeability and solubility for (R,E)-methyl 3,3,3-trifluoro-2-hydroxy-2-(4-((2-hydroxybenzylidene)amino)-3-methylphenyl)propanoate. Following Lipinski's Rule of Five, (R,E)-methyl 3,3,3-trifluoro-2-hydroxy-2-(4-((2-hydroxybenzylidene)amino)-3-methylphenyl)propanoate has 2 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 (R,E)-methyl 3,3,3-trifluoro-2-hydroxy-2-(4-((2-hydroxybenzylidene)amino)-3-methylphenyl)propanoate?
The CAS number of (R,E)-methyl 3,3,3-trifluoro-2-hydroxy-2-(4-((2-hydroxybenzylidene)amino)-3-methylphenyl)propanoate is 355148-17-3.
What is the molecular formula of (R,E)-methyl 3,3,3-trifluoro-2-hydroxy-2-(4-((2-hydroxybenzylidene)amino)-3-methylphenyl)propanoate?
The molecular formula of (R,E)-methyl 3,3,3-trifluoro-2-hydroxy-2-(4-((2-hydroxybenzylidene)amino)-3-methylphenyl)propanoate is C18H16F3NO4.
What is the molecular weight of (R,E)-methyl 3,3,3-trifluoro-2-hydroxy-2-(4-((2-hydroxybenzylidene)amino)-3-methylphenyl)propanoate?
The molecular weight of (R,E)-methyl 3,3,3-trifluoro-2-hydroxy-2-(4-((2-hydroxybenzylidene)amino)-3-methylphenyl)propanoate is 367.10 g/mol.
Where can I buy (R,E)-methyl 3,3,3-trifluoro-2-hydroxy-2-(4-((2-hydroxybenzylidene)amino)-3-methylphenyl)propanoate?
You can request a quote for (R,E)-methyl 3,3,3-trifluoro-2-hydroxy-2-(4-((2-hydroxybenzylidene)amino)-3-methylphenyl)propanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (R,E)-methyl 3,3,3-trifluoro-2-hydroxy-2-(4-((2-hydroxybenzylidene)amino)-3-methylphenyl)propanoate?
Yes, KEHONG BIO provides custom synthesis services for (R,E)-methyl 3,3,3-trifluoro-2-hydroxy-2-(4-((2-hydroxybenzylidene)amino)-3-methylphenyl)propanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.