![Diethyl 5-({[2-(3-butoxyphenyl)-4-quinolinyl]carbonyl}amino)isophthalate structure](/static/products/4382/438212-90-9.webp)
Diethyl 5-({[2-(3-butoxyphenyl)-4-quinolinyl]carbonyl}amino)isophthalate
TL;DR: Diethyl 5-({[2-(3-butoxyphenyl)-4-quinolinyl]carbonyl}amino)isophthalate (CAS 438212-90-9) is a chemical compound with molecular formula C32H32N2O6 and molecular weight 540.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
diethyl 5-[[2-(3-butoxyphenyl)quinoline-4-carbonyl]amino]benzene-1,3-dicarboxylate
Also Known As: diethyl 5-({[2-(3-butoxyphenyl)-4-quinolinyl]carbonyl}amino)isophthalate, diethyl 5-(2-(3-butoxyphenyl)quinoline-4-carboxamido)isophthalate, diethyl 5-[[2-(3-butoxyphenyl)quinoline-4-carbonyl]amino]benzene-1,3-dicarboxylate, diethyl 5-({[2-(3-butoxyphenyl)quinolin-4-yl]carbonyl}amino)benzene-1,3-dicarboxylate, ethyl 5-{[2-(3-butoxyphenyl)(4-quinolyl)]carbonylamino}-3-(ethoxycarbonyl)benz oate
| Molecular Formula | C32H32N2O6 |
|---|---|
| Molecular Weight | 540.23 g/mol |
| LogP | 6.6864 |
| Topological Polar Surface Area | 103.82 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 11 |
| Exact Mass | 540.226 |
| Heavy Atoms | 40 |
| Complexity | 1495.1322 |
Chemical Identifiers
| CAS Number | 438212-90-9 |
|---|---|
| SMILES | CCCCOC1=CC=CC(=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NC4=CC(=CC(=C4)C(=O)OCC)C(=O)OCC |
Product Overview
Diethyl 5-({[2-(3-butoxyphenyl)-4-quinolinyl]carbonyl}amino)isophthalate (CAS 438212-90-9), with molecular formula C32H32N2O6 and molecular weight 540.23 g/mol. IUPAC: diethyl 5-[[2-(3-butoxyphenyl)quinoline-4-carbonyl]amino]benzene-1,3-dicarboxylate.
Chemical Property Profile of Diethyl 5-({[2-(3-butoxyphenyl)-4-quinolinyl]carbonyl}amino)isophthalate
Property Insights of Diethyl 5-({[2-(3-butoxyphenyl)-4-quinolinyl]carbonyl}amino)isophthalate
The XLogP value of 6.6864 indicates that Diethyl 5-({[2-(3-butoxyphenyl)-4-quinolinyl]carbonyl}amino)isophthalate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 103.82 Ų falls within the moderate polarity range, balancing permeability and solubility for Diethyl 5-({[2-(3-butoxyphenyl)-4-quinolinyl]carbonyl}amino)isophthalate. Following Lipinski's Rule of Five, Diethyl 5-({[2-(3-butoxyphenyl)-4-quinolinyl]carbonyl}amino)isophthalate 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 5-({[2-(3-butoxyphenyl)-4-quinolinyl]carbonyl}amino)isophthalate?
The CAS number of Diethyl 5-({[2-(3-butoxyphenyl)-4-quinolinyl]carbonyl}amino)isophthalate is 438212-90-9.
What is the molecular formula of Diethyl 5-({[2-(3-butoxyphenyl)-4-quinolinyl]carbonyl}amino)isophthalate?
The molecular formula of Diethyl 5-({[2-(3-butoxyphenyl)-4-quinolinyl]carbonyl}amino)isophthalate is C32H32N2O6.
What is the molecular weight of Diethyl 5-({[2-(3-butoxyphenyl)-4-quinolinyl]carbonyl}amino)isophthalate?
The molecular weight of Diethyl 5-({[2-(3-butoxyphenyl)-4-quinolinyl]carbonyl}amino)isophthalate is 540.23 g/mol.
Where can I buy Diethyl 5-({[2-(3-butoxyphenyl)-4-quinolinyl]carbonyl}amino)isophthalate?
You can request a quote for Diethyl 5-({[2-(3-butoxyphenyl)-4-quinolinyl]carbonyl}amino)isophthalate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Diethyl 5-({[2-(3-butoxyphenyl)-4-quinolinyl]carbonyl}amino)isophthalate?
Yes, KEHONG BIO provides custom synthesis services for Diethyl 5-({[2-(3-butoxyphenyl)-4-quinolinyl]carbonyl}amino)isophthalate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.