8-Quinolinecarboxylic acid, (2,4-dichlorophenyl)methyl ester
TL;DR: 8-Quinolinecarboxylic acid, (2,4-dichlorophenyl)methyl ester (CAS 134959-57-2) is a chemical compound with molecular formula C17H11Cl2NO2 and molecular weight 331.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2,4-dichlorophenyl)methyl quinoline-8-carboxylate
Also Known As: 8-Quinolinecarboxylic acid, (2,4-dichlorophenyl)methyl ester, (2,4-dichlorophenyl)methyl quinoline-8-carboxylate, Quinoline-8-carboxylic acid 2,4-dichlorobenzyl ester, 8-Quinolinecarboxylicacid, (2,4-dichlorophenyl)methyl ester, 8-Quinolinecarboxylicacid,(2,4-dichlorophenyl)methyl ester
| Molecular Formula | C17H11Cl2NO2 |
|---|---|
| Molecular Weight | 331.02 g/mol |
| LogP | 4.8 |
| Topological Polar Surface Area | 39.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 331.0167 |
| Heavy Atoms | 22 |
| Complexity | 393.0 |
Chemical Identifiers
| CAS Number | 134959-57-2 |
|---|---|
| SMILES | C1=CC2=C(C(=C1)C(=O)OCC3=C(C=C(C=C3)Cl)Cl)N=CC=C2 |
| InChIKey | MMLPCEIVQASUHT-UHFFFAOYSA-N |
Product Overview
8-Quinolinecarboxylic acid, (2,4-dichlorophenyl)methyl ester (CAS 134959-57-2), with molecular formula C17H11Cl2NO2 and molecular weight 331.02 g/mol. IUPAC: (2,4-dichlorophenyl)methyl quinoline-8-carboxylate.
Chemical Property Profile of 8-Quinolinecarboxylic acid, (2,4-dichlorophenyl)methyl ester
Property Insights of 8-Quinolinecarboxylic acid, (2,4-dichlorophenyl)methyl ester
The XLogP value of 4.8 indicates that 8-Quinolinecarboxylic acid, (2,4-dichlorophenyl)methyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 39.2 Ų, 8-Quinolinecarboxylic acid, (2,4-dichlorophenyl)methyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 8-Quinolinecarboxylic acid, (2,4-dichlorophenyl)methyl ester 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 8-Quinolinecarboxylic acid, (2,4-dichlorophenyl)methyl ester?
The CAS number of 8-Quinolinecarboxylic acid, (2,4-dichlorophenyl)methyl ester is 134959-57-2.
What is the molecular formula of 8-Quinolinecarboxylic acid, (2,4-dichlorophenyl)methyl ester?
The molecular formula of 8-Quinolinecarboxylic acid, (2,4-dichlorophenyl)methyl ester is C17H11Cl2NO2.
What is the molecular weight of 8-Quinolinecarboxylic acid, (2,4-dichlorophenyl)methyl ester?
The molecular weight of 8-Quinolinecarboxylic acid, (2,4-dichlorophenyl)methyl ester is 331.02 g/mol.
Where can I buy 8-Quinolinecarboxylic acid, (2,4-dichlorophenyl)methyl ester?
You can request a quote for 8-Quinolinecarboxylic acid, (2,4-dichlorophenyl)methyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 8-Quinolinecarboxylic acid, (2,4-dichlorophenyl)methyl ester?
Yes, KEHONG BIO provides custom synthesis services for 8-Quinolinecarboxylic acid, (2,4-dichlorophenyl)methyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.