![Diethyl 5-({[6-bromo-2-(4-methylphenyl)-4-quinolinyl]carbonyl}amino)isophthalate structure](/static/products/4382/438213-29-7.webp)
Diethyl 5-({[6-bromo-2-(4-methylphenyl)-4-quinolinyl]carbonyl}amino)isophthalate
TL;DR: Diethyl 5-({[6-bromo-2-(4-methylphenyl)-4-quinolinyl]carbonyl}amino)isophthalate (CAS 438213-29-7) is a chemical compound with molecular formula C29H25BrN2O5 and molecular weight 560.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
diethyl 5-[[6-bromo-2-(4-methylphenyl)quinoline-4-carbonyl]amino]benzene-1,3-dicarboxylate
Also Known As: diethyl 5-({[6-bromo-2-(4-methylphenyl)-4-quinolinyl]carbonyl}amino)isophthalate, diethyl 5-(6-bromo-2-(p-tolyl)quinoline-4-carboxamido)isophthalate, diethyl 5-[[6-bromo-2-(4-methylphenyl)quinoline-4-carbonyl]amino]benzene-1,3-dicarboxylate, diethyl 5-({[6-bromo-2-(4-methylphenyl)quinolin-4-yl]carbonyl}amino)benzene-1,3-dicarboxylate, ethyl 5-{[6-bromo-2-(4-methylphenyl)(4-quinolyl)]carbonylamino}-3-(ethoxycarbo nyl)benzoate
| Molecular Formula | C29H25BrN2O5 |
|---|---|
| Molecular Weight | 560.09 g/mol |
| LogP | 6.57842 |
| Topological Polar Surface Area | 94.59 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 560.09467 |
| Heavy Atoms | 37 |
| Complexity | 1462.4517 |
Chemical Identifiers
| CAS Number | 438213-29-7 |
|---|---|
| SMILES | CCOC(=O)C1=CC(=CC(=C1)NC(=O)C2=CC(=NC3=C2C=C(C=C3)Br)C4=CC=C(C=C4)C)C(=O)OCC |
Product Overview
Diethyl 5-({[6-bromo-2-(4-methylphenyl)-4-quinolinyl]carbonyl}amino)isophthalate (CAS 438213-29-7), with molecular formula C29H25BrN2O5 and molecular weight 560.09 g/mol. IUPAC: diethyl 5-[[6-bromo-2-(4-methylphenyl)quinoline-4-carbonyl]amino]benzene-1,3-dicarboxylate.
Chemical Property Profile of Diethyl 5-({[6-bromo-2-(4-methylphenyl)-4-quinolinyl]carbonyl}amino)isophthalate
Property Insights of Diethyl 5-({[6-bromo-2-(4-methylphenyl)-4-quinolinyl]carbonyl}amino)isophthalate
The XLogP value of 6.57842 indicates that Diethyl 5-({[6-bromo-2-(4-methylphenyl)-4-quinolinyl]carbonyl}amino)isophthalate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 94.59 Ų falls within the moderate polarity range, balancing permeability and solubility for Diethyl 5-({[6-bromo-2-(4-methylphenyl)-4-quinolinyl]carbonyl}amino)isophthalate. Following Lipinski's Rule of Five, Diethyl 5-({[6-bromo-2-(4-methylphenyl)-4-quinolinyl]carbonyl}amino)isophthalate 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 5-({[6-bromo-2-(4-methylphenyl)-4-quinolinyl]carbonyl}amino)isophthalate?
The CAS number of Diethyl 5-({[6-bromo-2-(4-methylphenyl)-4-quinolinyl]carbonyl}amino)isophthalate is 438213-29-7.
What is the molecular formula of Diethyl 5-({[6-bromo-2-(4-methylphenyl)-4-quinolinyl]carbonyl}amino)isophthalate?
The molecular formula of Diethyl 5-({[6-bromo-2-(4-methylphenyl)-4-quinolinyl]carbonyl}amino)isophthalate is C29H25BrN2O5.
What is the molecular weight of Diethyl 5-({[6-bromo-2-(4-methylphenyl)-4-quinolinyl]carbonyl}amino)isophthalate?
The molecular weight of Diethyl 5-({[6-bromo-2-(4-methylphenyl)-4-quinolinyl]carbonyl}amino)isophthalate is 560.09 g/mol.
Where can I buy Diethyl 5-({[6-bromo-2-(4-methylphenyl)-4-quinolinyl]carbonyl}amino)isophthalate?
You can request a quote for Diethyl 5-({[6-bromo-2-(4-methylphenyl)-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-({[6-bromo-2-(4-methylphenyl)-4-quinolinyl]carbonyl}amino)isophthalate?
Yes, KEHONG BIO provides custom synthesis services for Diethyl 5-({[6-bromo-2-(4-methylphenyl)-4-quinolinyl]carbonyl}amino)isophthalate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.