4-Hydroxy-8-(1-methylethyl)-3-quinolinecarboxylic acid
TL;DR: 4-Hydroxy-8-(1-methylethyl)-3-quinolinecarboxylic acid (CAS 170648-70-1) is a chemical compound with molecular formula C13H13NO3 and molecular weight 231.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-oxo-8-propan-2-yl-1H-quinoline-3-carboxylic acid
Also Known As: 4-hydroxy-8-(propan-2-yl)quinoline-3-carboxylic acid, 4-Hydroxy-8-isopropylquinoline-3-carboxylic acid, 4-oxo-8-propan-2-yl-1H-quinoline-3-carboxylic Acid, 3-Quinolinecarboxylicacid,4-hydroxy-8-(1-methylethyl)-(9CI), 4-Hydroxy-8-isopropylquinoline-3-carboxylicacid
| Molecular Formula | C13H13NO3 |
|---|---|
| Molecular Weight | 231.09 g/mol |
| LogP | 3.0 |
| Topological Polar Surface Area | 66.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 231.08954 |
| Heavy Atoms | 17 |
| Complexity | 373.0 |
Chemical Identifiers
| CAS Number | 170648-70-1 |
|---|---|
| SMILES | CC(C)C1=CC=CC2=C1NC=C(C2=O)C(=O)O |
| InChIKey | KGDOGYITTVCUJA-UHFFFAOYSA-N |
Product Overview
4-Hydroxy-8-(1-methylethyl)-3-quinolinecarboxylic acid (CAS 170648-70-1), with molecular formula C13H13NO3 and molecular weight 231.09 g/mol. IUPAC: 4-oxo-8-propan-2-yl-1H-quinoline-3-carboxylic acid.
Chemical Property Profile of 4-Hydroxy-8-(1-methylethyl)-3-quinolinecarboxylic acid
Property Insights of 4-Hydroxy-8-(1-methylethyl)-3-quinolinecarboxylic acid
The XLogP value of 3.0 indicates that 4-Hydroxy-8-(1-methylethyl)-3-quinolinecarboxylic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Hydroxy-8-(1-methylethyl)-3-quinolinecarboxylic acid. Following Lipinski's Rule of Five, 4-Hydroxy-8-(1-methylethyl)-3-quinolinecarboxylic acid has 2 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-Hydroxy-8-(1-methylethyl)-3-quinolinecarboxylic acid?
The CAS number of 4-Hydroxy-8-(1-methylethyl)-3-quinolinecarboxylic acid is 170648-70-1.
What is the molecular formula of 4-Hydroxy-8-(1-methylethyl)-3-quinolinecarboxylic acid?
The molecular formula of 4-Hydroxy-8-(1-methylethyl)-3-quinolinecarboxylic acid is C13H13NO3.
What is the molecular weight of 4-Hydroxy-8-(1-methylethyl)-3-quinolinecarboxylic acid?
The molecular weight of 4-Hydroxy-8-(1-methylethyl)-3-quinolinecarboxylic acid is 231.09 g/mol.
Where can I buy 4-Hydroxy-8-(1-methylethyl)-3-quinolinecarboxylic acid?
You can request a quote for 4-Hydroxy-8-(1-methylethyl)-3-quinolinecarboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Hydroxy-8-(1-methylethyl)-3-quinolinecarboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-Hydroxy-8-(1-methylethyl)-3-quinolinecarboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.