2-(4-Bromophenyl)-2-oxoethyl 2-hydroxyquinoline-4-carboxylate
TL;DR: 2-(4-Bromophenyl)-2-oxoethyl 2-hydroxyquinoline-4-carboxylate (CAS 99098-97-2) is a chemical compound with molecular formula C18H12BrNO4 and molecular weight 384.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-(4-bromophenyl)-2-oxoethyl] 2-oxo-1H-quinoline-4-carboxylate
Also Known As: BAS 00397212, 2-(4-bromophenyl)-2-oxoethyl 2-hydroxyquinoline-4-carboxylate, 2-(4-bromophenyl)-2-oxoethyl 2-hydroxy-4-quinolinecarboxylate, [2-(4-bromophenyl)-2-oxoethyl] 2-oxo-1H-quinoline-4-carboxylate, 2-Hydroxy-quinoline-4-carboxylic acid 2-(4-bromo-phenyl)-2-oxo-ethyl ester
| Molecular Formula | C18H12BrNO4 |
|---|---|
| Molecular Weight | 384.99 g/mol |
| LogP | 3.3303 |
| Topological Polar Surface Area | 76.23 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 384.99496 |
| Heavy Atoms | 24 |
| Complexity | 976.22534 |
Chemical Identifiers
| CAS Number | 99098-97-2 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=CC(=O)N2)C(=O)OCC(=O)C3=CC=C(C=C3)Br |
Product Overview
2-(4-Bromophenyl)-2-oxoethyl 2-hydroxyquinoline-4-carboxylate (CAS 99098-97-2), with molecular formula C18H12BrNO4 and molecular weight 384.99 g/mol. IUPAC: [2-(4-bromophenyl)-2-oxoethyl] 2-oxo-1H-quinoline-4-carboxylate.
Chemical Property Profile of 2-(4-Bromophenyl)-2-oxoethyl 2-hydroxyquinoline-4-carboxylate
Property Insights of 2-(4-Bromophenyl)-2-oxoethyl 2-hydroxyquinoline-4-carboxylate
The XLogP value of 3.3303 indicates that 2-(4-Bromophenyl)-2-oxoethyl 2-hydroxyquinoline-4-carboxylate 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 2-(4-Bromophenyl)-2-oxoethyl 2-hydroxyquinoline-4-carboxylate. Following Lipinski's Rule of Five, 2-(4-Bromophenyl)-2-oxoethyl 2-hydroxyquinoline-4-carboxylate 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 2-(4-Bromophenyl)-2-oxoethyl 2-hydroxyquinoline-4-carboxylate?
The CAS number of 2-(4-Bromophenyl)-2-oxoethyl 2-hydroxyquinoline-4-carboxylate is 99098-97-2.
What is the molecular formula of 2-(4-Bromophenyl)-2-oxoethyl 2-hydroxyquinoline-4-carboxylate?
The molecular formula of 2-(4-Bromophenyl)-2-oxoethyl 2-hydroxyquinoline-4-carboxylate is C18H12BrNO4.
What is the molecular weight of 2-(4-Bromophenyl)-2-oxoethyl 2-hydroxyquinoline-4-carboxylate?
The molecular weight of 2-(4-Bromophenyl)-2-oxoethyl 2-hydroxyquinoline-4-carboxylate is 384.99 g/mol.
Where can I buy 2-(4-Bromophenyl)-2-oxoethyl 2-hydroxyquinoline-4-carboxylate?
You can request a quote for 2-(4-Bromophenyl)-2-oxoethyl 2-hydroxyquinoline-4-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(4-Bromophenyl)-2-oxoethyl 2-hydroxyquinoline-4-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for 2-(4-Bromophenyl)-2-oxoethyl 2-hydroxyquinoline-4-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.