3-ethyl 6-methyl 4-((4-((2-chlorobenzyl)oxy)phenyl)amino)quinoline-3,6-dicarboxylate
TL;DR: 3-ethyl 6-methyl 4-((4-((2-chlorobenzyl)oxy)phenyl)amino)quinoline-3,6-dicarboxylate (CAS 442564-18-3) is a chemical compound with molecular formula C27H23ClN2O5 and molecular weight 490.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-O-ethyl 6-O-methyl 4-[4-[(2-chlorophenyl)methoxy]anilino]quinoline-3,6-dicarboxylate
Also Known As: 3-ethyl 6-methyl 4-((4-((2-chlorobenzyl)oxy)phenyl)amino)quinoline-3,6-dicarboxylate, 3-ethyl 6-methyl 4-({4-[(2-chlorobenzyl)oxy]phenyl}amino)quinoline-3,6-dicarboxylate, 3-O-ethyl 6-O-methyl 4-[4-[(2-chlorophenyl)methoxy]anilino]quinoline-3,6-dicarboxylate, 3-ETHYL 6-METHYL 4-({4-[(2-CHLOROPHENYL)METHOXY]PHENYL}AMINO)QUINOLINE-3,6-DICARBOXYLATE, ethyl 4-({4-[(2-chlorophenyl)methoxy]phenyl}amino)-6-(methoxycarbonyl)quinolin e-3-carboxylate
| Molecular Formula | C27H23ClN2O5 |
|---|---|
| Molecular Weight | 490.13 g/mol |
| LogP | 6.1741 |
| Topological Polar Surface Area | 86.75 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 490.12955 |
| Heavy Atoms | 35 |
| Complexity | 1372.1251 |
Chemical Identifiers
| CAS Number | 442564-18-3 |
|---|---|
| SMILES | CCOC(=O)C1=CN=C2C=CC(=CC2=C1NC3=CC=C(C=C3)OCC4=CC=CC=C4Cl)C(=O)OC |
Product Overview
3-ethyl 6-methyl 4-((4-((2-chlorobenzyl)oxy)phenyl)amino)quinoline-3,6-dicarboxylate (CAS 442564-18-3), with molecular formula C27H23ClN2O5 and molecular weight 490.13 g/mol. IUPAC: 3-O-ethyl 6-O-methyl 4-[4-[(2-chlorophenyl)methoxy]anilino]quinoline-3,6-dicarboxylate.
Chemical Property Profile of 3-ethyl 6-methyl 4-((4-((2-chlorobenzyl)oxy)phenyl)amino)quinoline-3,6-dicarboxylate
Property Insights of 3-ethyl 6-methyl 4-((4-((2-chlorobenzyl)oxy)phenyl)amino)quinoline-3,6-dicarboxylate
The XLogP value of 6.1741 indicates that 3-ethyl 6-methyl 4-((4-((2-chlorobenzyl)oxy)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 3-ethyl 6-methyl 4-((4-((2-chlorobenzyl)oxy)phenyl)amino)quinoline-3,6-dicarboxylate. Following Lipinski's Rule of Five, 3-ethyl 6-methyl 4-((4-((2-chlorobenzyl)oxy)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 3-ethyl 6-methyl 4-((4-((2-chlorobenzyl)oxy)phenyl)amino)quinoline-3,6-dicarboxylate?
The CAS number of 3-ethyl 6-methyl 4-((4-((2-chlorobenzyl)oxy)phenyl)amino)quinoline-3,6-dicarboxylate is 442564-18-3.
What is the molecular formula of 3-ethyl 6-methyl 4-((4-((2-chlorobenzyl)oxy)phenyl)amino)quinoline-3,6-dicarboxylate?
The molecular formula of 3-ethyl 6-methyl 4-((4-((2-chlorobenzyl)oxy)phenyl)amino)quinoline-3,6-dicarboxylate is C27H23ClN2O5.
What is the molecular weight of 3-ethyl 6-methyl 4-((4-((2-chlorobenzyl)oxy)phenyl)amino)quinoline-3,6-dicarboxylate?
The molecular weight of 3-ethyl 6-methyl 4-((4-((2-chlorobenzyl)oxy)phenyl)amino)quinoline-3,6-dicarboxylate is 490.13 g/mol.
Where can I buy 3-ethyl 6-methyl 4-((4-((2-chlorobenzyl)oxy)phenyl)amino)quinoline-3,6-dicarboxylate?
You can request a quote for 3-ethyl 6-methyl 4-((4-((2-chlorobenzyl)oxy)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 3-ethyl 6-methyl 4-((4-((2-chlorobenzyl)oxy)phenyl)amino)quinoline-3,6-dicarboxylate?
Yes, KEHONG BIO provides custom synthesis services for 3-ethyl 6-methyl 4-((4-((2-chlorobenzyl)oxy)phenyl)amino)quinoline-3,6-dicarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.