6-Bromo-3-methyl-2-(4-methylphenyl)quinoline-4-carboxylate
TL;DR: 6-Bromo-3-methyl-2-(4-methylphenyl)quinoline-4-carboxylate (CAS 6742-55-8) is a chemical compound with molecular formula C18H13BrNO2- and molecular weight 354.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-bromo-3-methyl-2-(4-methylphenyl)quinoline-4-carboxylate
Also Known As: Benzene,(3,5-dioctylpentadecyl)-, 6-bromo-3-methyl-2-(4-methylphenyl)quinoline-4-carboxylate
| Molecular Formula | C18H13BrNO2- |
|---|---|
| Molecular Weight | 354.01 g/mol |
| LogP | 3.64464 |
| Topological Polar Surface Area | 53.02 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 354.01297 |
| Heavy Atoms | 22 |
| Complexity | 885.7229 |
Chemical Identifiers
| CAS Number | 6742-55-8 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C2=NC3=C(C=C(C=C3)Br)C(=C2C)C(=O)[O-] |
Product Overview
6-Bromo-3-methyl-2-(4-methylphenyl)quinoline-4-carboxylate (CAS 6742-55-8), with molecular formula C18H13BrNO2- and molecular weight 354.01 g/mol. IUPAC: 6-bromo-3-methyl-2-(4-methylphenyl)quinoline-4-carboxylate.
Chemical Property Profile of 6-Bromo-3-methyl-2-(4-methylphenyl)quinoline-4-carboxylate
Property Insights of 6-Bromo-3-methyl-2-(4-methylphenyl)quinoline-4-carboxylate
The XLogP value of 3.64464 indicates that 6-Bromo-3-methyl-2-(4-methylphenyl)quinoline-4-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 53.02 Ų, 6-Bromo-3-methyl-2-(4-methylphenyl)quinoline-4-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-Bromo-3-methyl-2-(4-methylphenyl)quinoline-4-carboxylate has 0 hydrogen bond donor(s) and 3 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 6-Bromo-3-methyl-2-(4-methylphenyl)quinoline-4-carboxylate?
The CAS number of 6-Bromo-3-methyl-2-(4-methylphenyl)quinoline-4-carboxylate is 6742-55-8.
What is the molecular formula of 6-Bromo-3-methyl-2-(4-methylphenyl)quinoline-4-carboxylate?
The molecular formula of 6-Bromo-3-methyl-2-(4-methylphenyl)quinoline-4-carboxylate is C18H13BrNO2-.
What is the molecular weight of 6-Bromo-3-methyl-2-(4-methylphenyl)quinoline-4-carboxylate?
The molecular weight of 6-Bromo-3-methyl-2-(4-methylphenyl)quinoline-4-carboxylate is 354.01 g/mol.
Where can I buy 6-Bromo-3-methyl-2-(4-methylphenyl)quinoline-4-carboxylate?
You can request a quote for 6-Bromo-3-methyl-2-(4-methylphenyl)quinoline-4-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-Bromo-3-methyl-2-(4-methylphenyl)quinoline-4-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for 6-Bromo-3-methyl-2-(4-methylphenyl)quinoline-4-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.