6-Butyl-4-hydroxyquinoline-3-carboxylic acid
TL;DR: 6-Butyl-4-hydroxyquinoline-3-carboxylic acid (CAS 53977-28-9) is a chemical compound with molecular formula C14H15NO3 and molecular weight 245.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-butyl-4-oxo-1H-quinoline-3-carboxylic acid
Also Known As: 6-butyl-4-hydroxyquinoline-3-carboxylic acid, 6-BUTYL-4-OXO-1,4-DIHYDROQUINOLINE-3-CARBOXYLIC ACID, 6-butyl-4-oxo-1H-quinoline-3-carboxylic Acid, 6-butyl-4-oxohydroquinoline-3-carboxylic acid, 6-BUTYL-4-HYDROXY-3-QUINOLINECARBOXYLIC ACID
| Molecular Formula | C14H15NO3 |
|---|---|
| Molecular Weight | 245.11 g/mol |
| LogP | 2.5689 |
| Topological Polar Surface Area | 70.16 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 245.1052 |
| Heavy Atoms | 18 |
| Complexity | 643.0194 |
Chemical Identifiers
| CAS Number | 53977-28-9 |
|---|---|
| SMILES | CCCCC1=CC2=C(C=C1)NC=C(C2=O)C(=O)O |
Product Overview
6-Butyl-4-hydroxyquinoline-3-carboxylic acid (CAS 53977-28-9), with molecular formula C14H15NO3 and molecular weight 245.11 g/mol. IUPAC: 6-butyl-4-oxo-1H-quinoline-3-carboxylic acid.
Chemical Property Profile of 6-Butyl-4-hydroxyquinoline-3-carboxylic acid
Property Insights of 6-Butyl-4-hydroxyquinoline-3-carboxylic acid
The XLogP value of 2.5689 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-Butyl-4-hydroxyquinoline-3-carboxylic acid. The TPSA of 70.16 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-Butyl-4-hydroxyquinoline-3-carboxylic acid. Following Lipinski's Rule of Five, 6-Butyl-4-hydroxyquinoline-3-carboxylic acid has 2 hydrogen bond donor(s) and 2 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-Butyl-4-hydroxyquinoline-3-carboxylic acid?
The CAS number of 6-Butyl-4-hydroxyquinoline-3-carboxylic acid is 53977-28-9.
What is the molecular formula of 6-Butyl-4-hydroxyquinoline-3-carboxylic acid?
The molecular formula of 6-Butyl-4-hydroxyquinoline-3-carboxylic acid is C14H15NO3.
What is the molecular weight of 6-Butyl-4-hydroxyquinoline-3-carboxylic acid?
The molecular weight of 6-Butyl-4-hydroxyquinoline-3-carboxylic acid is 245.11 g/mol.
Where can I buy 6-Butyl-4-hydroxyquinoline-3-carboxylic acid?
You can request a quote for 6-Butyl-4-hydroxyquinoline-3-carboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-Butyl-4-hydroxyquinoline-3-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 6-Butyl-4-hydroxyquinoline-3-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.