8-Methyl-quinoline-2,3-dicarboxylic acid
TL;DR: 8-Methyl-quinoline-2,3-dicarboxylic acid (CAS 892874-73-6) is a chemical compound with molecular formula C17H24BrN3O2 and molecular weight 381.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl (2E)-2-[(4-bromophenyl)hydrazinylidene]-2-[(2R,6R)-2,6-dimethylpiperidin-1-yl]acetate
Also Known As: 8-Methyl-quinoline-2,3-dicarboxylic acid
| Molecular Formula | C17H24BrN3O2 |
|---|---|
| Molecular Weight | 381.11 g/mol |
| LogP | 4.0005 |
| Topological Polar Surface Area | 53.93 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 381.1052 |
| Heavy Atoms | 23 |
| Complexity | 549.46185 |
Chemical Identifiers
| CAS Number | 892874-73-6 |
|---|---|
| SMILES | CCOC(=O)/C(=N\NC1=CC=C(C=C1)Br)/N2[C@@H](CCC[C@H]2C)C |
Product Overview
8-Methyl-quinoline-2,3-dicarboxylic acid (CAS 892874-73-6), with molecular formula C17H24BrN3O2 and molecular weight 381.11 g/mol. IUPAC: ethyl (2E)-2-[(4-bromophenyl)hydrazinylidene]-2-[(2R,6R)-2,6-dimethylpiperidin-1-yl]acetate.
Chemical Property Profile of 8-Methyl-quinoline-2,3-dicarboxylic acid
Property Insights of 8-Methyl-quinoline-2,3-dicarboxylic acid
The XLogP value of 4.0005 indicates that 8-Methyl-quinoline-2,3-dicarboxylic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 53.93 Ų, 8-Methyl-quinoline-2,3-dicarboxylic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 8-Methyl-quinoline-2,3-dicarboxylic acid 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 8-Methyl-quinoline-2,3-dicarboxylic acid?
The CAS number of 8-Methyl-quinoline-2,3-dicarboxylic acid is 892874-73-6.
What is the molecular formula of 8-Methyl-quinoline-2,3-dicarboxylic acid?
The molecular formula of 8-Methyl-quinoline-2,3-dicarboxylic acid is C17H24BrN3O2.
What is the molecular weight of 8-Methyl-quinoline-2,3-dicarboxylic acid?
The molecular weight of 8-Methyl-quinoline-2,3-dicarboxylic acid is 381.11 g/mol.
Where can I buy 8-Methyl-quinoline-2,3-dicarboxylic acid?
You can request a quote for 8-Methyl-quinoline-2,3-dicarboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 8-Methyl-quinoline-2,3-dicarboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 8-Methyl-quinoline-2,3-dicarboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.