Diethyl 4-((3,4-dichlorophenyl)amino)quinoline-3,6-dicarboxylate
TL;DR: Diethyl 4-((3,4-dichlorophenyl)amino)quinoline-3,6-dicarboxylate (CAS 385388-84-1) is a chemical compound with molecular formula C21H18Cl2N2O4 and molecular weight 432.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
diethyl 4-(3,4-dichloroanilino)quinoline-3,6-dicarboxylate
Also Known As: diethyl 4-(3,4-dichloroanilino)quinoline-3,6-dicarboxylate, diethyl 4-((3,4-dichlorophenyl)amino)quinoline-3,6-dicarboxylate, diethyl 4-[(3,4-dichlorophenyl)amino]quinoline-3,6-dicarboxylate, ethyl 4-[(3,4-dichlorophenyl)amino]-6-(ethoxycarbonyl)quinoline-3-carboxylate
| Molecular Formula | C21H18Cl2N2O4 |
|---|---|
| Molecular Weight | 432.06 g/mol |
| LogP | 5.6386 |
| Topological Polar Surface Area | 77.52 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 432.06436 |
| Heavy Atoms | 29 |
| Complexity | 1080.4594 |
Chemical Identifiers
| CAS Number | 385388-84-1 |
|---|---|
| SMILES | CCOC(=O)C1=CC2=C(C(=CN=C2C=C1)C(=O)OCC)NC3=CC(=C(C=C3)Cl)Cl |
Product Overview
Diethyl 4-((3,4-dichlorophenyl)amino)quinoline-3,6-dicarboxylate (CAS 385388-84-1), with molecular formula C21H18Cl2N2O4 and molecular weight 432.06 g/mol. IUPAC: diethyl 4-(3,4-dichloroanilino)quinoline-3,6-dicarboxylate.
Chemical Property Profile of Diethyl 4-((3,4-dichlorophenyl)amino)quinoline-3,6-dicarboxylate
Property Insights of Diethyl 4-((3,4-dichlorophenyl)amino)quinoline-3,6-dicarboxylate
The XLogP value of 5.6386 indicates that Diethyl 4-((3,4-dichlorophenyl)amino)quinoline-3,6-dicarboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 77.52 Ų falls within the moderate polarity range, balancing permeability and solubility for Diethyl 4-((3,4-dichlorophenyl)amino)quinoline-3,6-dicarboxylate. Following Lipinski's Rule of Five, Diethyl 4-((3,4-dichlorophenyl)amino)quinoline-3,6-dicarboxylate has 1 hydrogen bond donor(s) and 6 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-((3,4-dichlorophenyl)amino)quinoline-3,6-dicarboxylate?
The CAS number of Diethyl 4-((3,4-dichlorophenyl)amino)quinoline-3,6-dicarboxylate is 385388-84-1.
What is the molecular formula of Diethyl 4-((3,4-dichlorophenyl)amino)quinoline-3,6-dicarboxylate?
The molecular formula of Diethyl 4-((3,4-dichlorophenyl)amino)quinoline-3,6-dicarboxylate is C21H18Cl2N2O4.
What is the molecular weight of Diethyl 4-((3,4-dichlorophenyl)amino)quinoline-3,6-dicarboxylate?
The molecular weight of Diethyl 4-((3,4-dichlorophenyl)amino)quinoline-3,6-dicarboxylate is 432.06 g/mol.
Where can I buy Diethyl 4-((3,4-dichlorophenyl)amino)quinoline-3,6-dicarboxylate?
You can request a quote for Diethyl 4-((3,4-dichlorophenyl)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-((3,4-dichlorophenyl)amino)quinoline-3,6-dicarboxylate?
Yes, KEHONG BIO provides custom synthesis services for Diethyl 4-((3,4-dichlorophenyl)amino)quinoline-3,6-dicarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.