Diethyl 4-((4-(benzyloxy)phenyl)amino)quinoline-3,6-dicarboxylate
TL;DR: Diethyl 4-((4-(benzyloxy)phenyl)amino)quinoline-3,6-dicarboxylate (CAS 459417-29-9) is a chemical compound with molecular formula C28H26N2O5 and molecular weight 470.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
diethyl 4-(4-phenylmethoxyanilino)quinoline-3,6-dicarboxylate
Also Known As: diethyl 4-(4-phenylmethoxyanilino)quinoline-3,6-dicarboxylate, diethyl 4-((4-(benzyloxy)phenyl)amino)quinoline-3,6-dicarboxylate, diethyl 4-{[4-(benzyloxy)phenyl]amino}quinoline-3,6-dicarboxylate, ethyl 6-(ethoxycarbonyl)-4-{[4-(phenylmethoxy)phenyl]amino}quinoline-3-carboxy late
| Molecular Formula | C28H26N2O5 |
|---|---|
| Molecular Weight | 470.18 g/mol |
| LogP | 5.9108 |
| Topological Polar Surface Area | 86.75 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 9 |
| Exact Mass | 470.18417 |
| Heavy Atoms | 35 |
| Complexity | 1315.5216 |
Chemical Identifiers
| CAS Number | 459417-29-9 |
|---|---|
| SMILES | CCOC(=O)C1=CC2=C(C(=CN=C2C=C1)C(=O)OCC)NC3=CC=C(C=C3)OCC4=CC=CC=C4 |
Product Overview
Diethyl 4-((4-(benzyloxy)phenyl)amino)quinoline-3,6-dicarboxylate (CAS 459417-29-9), with molecular formula C28H26N2O5 and molecular weight 470.18 g/mol. IUPAC: diethyl 4-(4-phenylmethoxyanilino)quinoline-3,6-dicarboxylate.
Chemical Property Profile of Diethyl 4-((4-(benzyloxy)phenyl)amino)quinoline-3,6-dicarboxylate
Property Insights of Diethyl 4-((4-(benzyloxy)phenyl)amino)quinoline-3,6-dicarboxylate
The XLogP value of 5.9108 indicates that Diethyl 4-((4-(benzyloxy)phenyl)amino)quinoline-3,6-dicarboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 86.75 Ų falls within the moderate polarity range, balancing permeability and solubility for Diethyl 4-((4-(benzyloxy)phenyl)amino)quinoline-3,6-dicarboxylate. Following Lipinski's Rule of Five, Diethyl 4-((4-(benzyloxy)phenyl)amino)quinoline-3,6-dicarboxylate has 1 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 Diethyl 4-((4-(benzyloxy)phenyl)amino)quinoline-3,6-dicarboxylate?
The CAS number of Diethyl 4-((4-(benzyloxy)phenyl)amino)quinoline-3,6-dicarboxylate is 459417-29-9.
What is the molecular formula of Diethyl 4-((4-(benzyloxy)phenyl)amino)quinoline-3,6-dicarboxylate?
The molecular formula of Diethyl 4-((4-(benzyloxy)phenyl)amino)quinoline-3,6-dicarboxylate is C28H26N2O5.
What is the molecular weight of Diethyl 4-((4-(benzyloxy)phenyl)amino)quinoline-3,6-dicarboxylate?
The molecular weight of Diethyl 4-((4-(benzyloxy)phenyl)amino)quinoline-3,6-dicarboxylate is 470.18 g/mol.
Where can I buy Diethyl 4-((4-(benzyloxy)phenyl)amino)quinoline-3,6-dicarboxylate?
You can request a quote for Diethyl 4-((4-(benzyloxy)phenyl)amino)quinoline-3,6-dicarboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Diethyl 4-((4-(benzyloxy)phenyl)amino)quinoline-3,6-dicarboxylate?
Yes, KEHONG BIO provides custom synthesis services for Diethyl 4-((4-(benzyloxy)phenyl)amino)quinoline-3,6-dicarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.