4-Quinolinecarboxylic acid,6-bromo-1,2-dihydro-2-oxo-,2-(4-bromophenyl)-2-oxoethyl ester
TL;DR: 4-Quinolinecarboxylic acid,6-bromo-1,2-dihydro-2-oxo-,2-(4-bromophenyl)-2-oxoethyl ester (CAS 445406-13-3) is a chemical compound with molecular formula C18H11Br2NO4 and molecular weight 462.91 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-(4-bromophenyl)-2-oxoethyl] 6-bromo-2-oxo-1H-quinoline-4-carboxylate
Also Known As: 4-Quinolinecarboxylic acid,6-bromo-1,2-dihydro-2-oxo-,2-(4-bromophenyl)-2-oxoethyl ester, AM-879/40736231, 2-(4-bromophenyl)-2-oxoethyl 6-bromo-2-oxo-1,2-dihydroquinoline-4-carboxylate, 2-(4-bromophenyl)-2-oxoethyl 6-bromo-2-hydroxy-4-quinolinecarboxylate, [2-(4-bromophenyl)-2-oxoethyl] 6-bromo-2-oxo-1H-quinoline-4-carboxylate
| Molecular Formula | C18H11Br2NO4 |
|---|---|
| Molecular Weight | 462.91 g/mol |
| LogP | 4.0928 |
| Topological Polar Surface Area | 76.23 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 462.9055 |
| Heavy Atoms | 25 |
| Complexity | 1025.4207 |
Chemical Identifiers
| CAS Number | 445406-13-3 |
|---|---|
| SMILES | C1=CC(=CC=C1C(=O)COC(=O)C2=CC(=O)NC3=C2C=C(C=C3)Br)Br |
Product Overview
4-Quinolinecarboxylic acid,6-bromo-1,2-dihydro-2-oxo-,2-(4-bromophenyl)-2-oxoethyl ester (CAS 445406-13-3), with molecular formula C18H11Br2NO4 and molecular weight 462.91 g/mol. IUPAC: [2-(4-bromophenyl)-2-oxoethyl] 6-bromo-2-oxo-1H-quinoline-4-carboxylate.
Chemical Property Profile of 4-Quinolinecarboxylic acid,6-bromo-1,2-dihydro-2-oxo-,2-(4-bromophenyl)-2-oxoethyl ester
Property Insights of 4-Quinolinecarboxylic acid,6-bromo-1,2-dihydro-2-oxo-,2-(4-bromophenyl)-2-oxoethyl ester
The XLogP value of 4.0928 indicates that 4-Quinolinecarboxylic acid,6-bromo-1,2-dihydro-2-oxo-,2-(4-bromophenyl)-2-oxoethyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 76.23 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Quinolinecarboxylic acid,6-bromo-1,2-dihydro-2-oxo-,2-(4-bromophenyl)-2-oxoethyl ester. Following Lipinski's Rule of Five, 4-Quinolinecarboxylic acid,6-bromo-1,2-dihydro-2-oxo-,2-(4-bromophenyl)-2-oxoethyl ester has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4-Quinolinecarboxylic acid,6-bromo-1,2-dihydro-2-oxo-,2-(4-bromophenyl)-2-oxoethyl ester?
The CAS number of 4-Quinolinecarboxylic acid,6-bromo-1,2-dihydro-2-oxo-,2-(4-bromophenyl)-2-oxoethyl ester is 445406-13-3.
What is the molecular formula of 4-Quinolinecarboxylic acid,6-bromo-1,2-dihydro-2-oxo-,2-(4-bromophenyl)-2-oxoethyl ester?
The molecular formula of 4-Quinolinecarboxylic acid,6-bromo-1,2-dihydro-2-oxo-,2-(4-bromophenyl)-2-oxoethyl ester is C18H11Br2NO4.
What is the molecular weight of 4-Quinolinecarboxylic acid,6-bromo-1,2-dihydro-2-oxo-,2-(4-bromophenyl)-2-oxoethyl ester?
The molecular weight of 4-Quinolinecarboxylic acid,6-bromo-1,2-dihydro-2-oxo-,2-(4-bromophenyl)-2-oxoethyl ester is 462.91 g/mol.
Where can I buy 4-Quinolinecarboxylic acid,6-bromo-1,2-dihydro-2-oxo-,2-(4-bromophenyl)-2-oxoethyl ester?
You can request a quote for 4-Quinolinecarboxylic acid,6-bromo-1,2-dihydro-2-oxo-,2-(4-bromophenyl)-2-oxoethyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Quinolinecarboxylic acid,6-bromo-1,2-dihydro-2-oxo-,2-(4-bromophenyl)-2-oxoethyl ester?
Yes, KEHONG BIO provides custom synthesis services for 4-Quinolinecarboxylic acid,6-bromo-1,2-dihydro-2-oxo-,2-(4-bromophenyl)-2-oxoethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.