![diisopropyl 5-({[6-bromo-2-(4-methylphenyl)-4-quinolinyl]carbonyl}amino)isophthalate structure](/static/products/4382/438213-90-2.webp)
diisopropyl 5-({[6-bromo-2-(4-methylphenyl)-4-quinolinyl]carbonyl}amino)isophthalate
TL;DR: diisopropyl 5-({[6-bromo-2-(4-methylphenyl)-4-quinolinyl]carbonyl}amino)isophthalate (CAS 438213-90-2) is a chemical compound with molecular formula C31H29BrN2O5 and molecular weight 588.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dipropan-2-yl 5-[[6-bromo-2-(4-methylphenyl)quinoline-4-carbonyl]amino]benzene-1,3-dicarboxylate
Also Known As: diisopropyl 5-({[6-bromo-2-(4-methylphenyl)-4-quinolinyl]carbonyl}amino)isophthalate, diisopropyl 5-(6-bromo-2-(p-tolyl)quinoline-4-carboxamido)isophthalate, dipropan-2-yl 5-[[6-bromo-2-(4-methylphenyl)quinoline-4-carbonyl]amino]benzene-1,3-dicarboxylate, dipropan-2-yl 5-({[6-bromo-2-(4-methylphenyl)quinolin-4-yl]carbonyl}amino)benzene-1,3-dicarboxylate, methylethyl 5-{[6-bromo-2-(4-methylphenyl)(4-quinolyl)]carbonylamino}-3-[(meth ylethyl)oxycarbonyl]benzoate
| Molecular Formula | C31H29BrN2O5 |
|---|---|
| Molecular Weight | 588.13 g/mol |
| LogP | 7.35542 |
| Topological Polar Surface Area | 94.59 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 588.126 |
| Heavy Atoms | 39 |
| Complexity | 1521.5513 |
Chemical Identifiers
| CAS Number | 438213-90-2 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C2=NC3=C(C=C(C=C3)Br)C(=C2)C(=O)NC4=CC(=CC(=C4)C(=O)OC(C)C)C(=O)OC(C)C |
Product Overview
diisopropyl 5-({[6-bromo-2-(4-methylphenyl)-4-quinolinyl]carbonyl}amino)isophthalate (CAS 438213-90-2), with molecular formula C31H29BrN2O5 and molecular weight 588.13 g/mol. IUPAC: dipropan-2-yl 5-[[6-bromo-2-(4-methylphenyl)quinoline-4-carbonyl]amino]benzene-1,3-dicarboxylate.
Chemical Property Profile of diisopropyl 5-({[6-bromo-2-(4-methylphenyl)-4-quinolinyl]carbonyl}amino)isophthalate
Property Insights of diisopropyl 5-({[6-bromo-2-(4-methylphenyl)-4-quinolinyl]carbonyl}amino)isophthalate
The XLogP value of 7.35542 indicates that diisopropyl 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 diisopropyl 5-({[6-bromo-2-(4-methylphenyl)-4-quinolinyl]carbonyl}amino)isophthalate. Following Lipinski's Rule of Five, diisopropyl 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 diisopropyl 5-({[6-bromo-2-(4-methylphenyl)-4-quinolinyl]carbonyl}amino)isophthalate?
The CAS number of diisopropyl 5-({[6-bromo-2-(4-methylphenyl)-4-quinolinyl]carbonyl}amino)isophthalate is 438213-90-2.
What is the molecular formula of diisopropyl 5-({[6-bromo-2-(4-methylphenyl)-4-quinolinyl]carbonyl}amino)isophthalate?
The molecular formula of diisopropyl 5-({[6-bromo-2-(4-methylphenyl)-4-quinolinyl]carbonyl}amino)isophthalate is C31H29BrN2O5.
What is the molecular weight of diisopropyl 5-({[6-bromo-2-(4-methylphenyl)-4-quinolinyl]carbonyl}amino)isophthalate?
The molecular weight of diisopropyl 5-({[6-bromo-2-(4-methylphenyl)-4-quinolinyl]carbonyl}amino)isophthalate is 588.13 g/mol.
Where can I buy diisopropyl 5-({[6-bromo-2-(4-methylphenyl)-4-quinolinyl]carbonyl}amino)isophthalate?
You can request a quote for diisopropyl 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 diisopropyl 5-({[6-bromo-2-(4-methylphenyl)-4-quinolinyl]carbonyl}amino)isophthalate?
Yes, KEHONG BIO provides custom synthesis services for diisopropyl 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.