![Ethyl 4-[(3,4-dichlorophenyl)amino]-6-(methoxycarbonyl)quinoline-3-carboxylate structure](/static/products/459/459417-15-3.png)
Ethyl 4-[(3,4-dichlorophenyl)amino]-6-(methoxycarbonyl)quinoline-3-carboxylate
TL;DR: Ethyl 4-[(3,4-dichlorophenyl)amino]-6-(methoxycarbonyl)quinoline-3-carboxylate (CAS 459417-15-3) is a chemical compound with molecular formula C20H16Cl2N2O4 and molecular weight 418.05 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-(3,4-dichloroanilino)quinoline-3,6-dicarboxylate
Also Known As: 3-ethyl 6-methyl 4-((3,4-dichlorophenyl)amino)quinoline-3,6-dicarboxylate, 3-ethyl 6-methyl 4-[(3,4-dichlorophenyl)amino]quinoline-3,6-dicarboxylate, ethyl 4-[(3,4-dichlorophenyl)amino]-6-(methoxycarbonyl)quinoline-3-carboxylate
| Molecular Formula | C20H16Cl2N2O4 |
|---|---|
| Molecular Weight | 418.05 g/mol |
| LogP | 5.2485 |
| Topological Polar Surface Area | 77.52 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 418.0487 |
| Heavy Atoms | 28 |
| Complexity | 1069.5002 |
Chemical Identifiers
| CAS Number | 459417-15-3 |
|---|---|
| SMILES | CCOC(=O)C1=CN=C2C=CC(=CC2=C1NC3=CC(=C(C=C3)Cl)Cl)C(=O)OC |
Product Overview
Ethyl 4-[(3,4-dichlorophenyl)amino]-6-(methoxycarbonyl)quinoline-3-carboxylate (CAS 459417-15-3), with molecular formula C20H16Cl2N2O4 and molecular weight 418.05 g/mol. IUPAC: 3-O-ethyl 6-O-methyl 4-(3,4-dichloroanilino)quinoline-3,6-dicarboxylate.
Chemical Property Profile of Ethyl 4-[(3,4-dichlorophenyl)amino]-6-(methoxycarbonyl)quinoline-3-carboxylate
Property Insights of Ethyl 4-[(3,4-dichlorophenyl)amino]-6-(methoxycarbonyl)quinoline-3-carboxylate
The XLogP value of 5.2485 indicates that Ethyl 4-[(3,4-dichlorophenyl)amino]-6-(methoxycarbonyl)quinoline-3-carboxylate 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 Ethyl 4-[(3,4-dichlorophenyl)amino]-6-(methoxycarbonyl)quinoline-3-carboxylate. Following Lipinski's Rule of Five, Ethyl 4-[(3,4-dichlorophenyl)amino]-6-(methoxycarbonyl)quinoline-3-carboxylate 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 Ethyl 4-[(3,4-dichlorophenyl)amino]-6-(methoxycarbonyl)quinoline-3-carboxylate?
The CAS number of Ethyl 4-[(3,4-dichlorophenyl)amino]-6-(methoxycarbonyl)quinoline-3-carboxylate is 459417-15-3.
What is the molecular formula of Ethyl 4-[(3,4-dichlorophenyl)amino]-6-(methoxycarbonyl)quinoline-3-carboxylate?
The molecular formula of Ethyl 4-[(3,4-dichlorophenyl)amino]-6-(methoxycarbonyl)quinoline-3-carboxylate is C20H16Cl2N2O4.
What is the molecular weight of Ethyl 4-[(3,4-dichlorophenyl)amino]-6-(methoxycarbonyl)quinoline-3-carboxylate?
The molecular weight of Ethyl 4-[(3,4-dichlorophenyl)amino]-6-(methoxycarbonyl)quinoline-3-carboxylate is 418.05 g/mol.
Where can I buy Ethyl 4-[(3,4-dichlorophenyl)amino]-6-(methoxycarbonyl)quinoline-3-carboxylate?
You can request a quote for Ethyl 4-[(3,4-dichlorophenyl)amino]-6-(methoxycarbonyl)quinoline-3-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 4-[(3,4-dichlorophenyl)amino]-6-(methoxycarbonyl)quinoline-3-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 4-[(3,4-dichlorophenyl)amino]-6-(methoxycarbonyl)quinoline-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.