1,4-Dihydro-6-fluoro-4-oxoquinoline-3-carboxylic acid
TL;DR: 1,4-Dihydro-6-fluoro-4-oxoquinoline-3-carboxylic acid (CAS 21640-48-2) is a chemical compound with molecular formula C10H6FNO3 and molecular weight 207.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-fluoro-4-oxo-1H-quinoline-3-carboxylic acid
Also Known As: 6-fluoro-4-hydroxyquinoline-3-carboxylic acid, null, 6-fluoro-4-oxo-1,4-dihydroquinoline-3-carboxylic acid, 5-chloro salicylic acid, 6-fluoro-4-oxo-1H-quinoline-3-carboxylic acid
| Molecular Formula | C10H6FNO3 |
|---|---|
| Molecular Weight | 207.03 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 66.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 207.03317 |
| Heavy Atoms | 15 |
| Complexity | 340.0 |
Chemical Identifiers
| CAS Number | 21640-48-2 |
|---|---|
| SMILES | C1=CC2=C(C=C1F)C(=O)C(=CN2)C(=O)O |
| InChIKey | KCEJQAATYWQMMQ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,4-Dihydro-6-fluoro-4-oxoquinoline-3-carboxylic acid (CAS 21640-48-2), with molecular formula C10H6FNO3 and molecular weight 207.03 g/mol. IUPAC: 6-fluoro-4-oxo-1H-quinoline-3-carboxylic acid.
Chemical Property Profile of 1,4-Dihydro-6-fluoro-4-oxoquinoline-3-carboxylic acid
Property Insights of 1,4-Dihydro-6-fluoro-4-oxoquinoline-3-carboxylic acid
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,4-Dihydro-6-fluoro-4-oxoquinoline-3-carboxylic acid. The TPSA of 66.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,4-Dihydro-6-fluoro-4-oxoquinoline-3-carboxylic acid. Following Lipinski's Rule of Five, 1,4-Dihydro-6-fluoro-4-oxoquinoline-3-carboxylic acid has 2 hydrogen bond donor(s) and 5 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 1,4-Dihydro-6-fluoro-4-oxoquinoline-3-carboxylic acid?
The CAS number of 1,4-Dihydro-6-fluoro-4-oxoquinoline-3-carboxylic acid is 21640-48-2.
What is the molecular formula of 1,4-Dihydro-6-fluoro-4-oxoquinoline-3-carboxylic acid?
The molecular formula of 1,4-Dihydro-6-fluoro-4-oxoquinoline-3-carboxylic acid is C10H6FNO3.
What is the molecular weight of 1,4-Dihydro-6-fluoro-4-oxoquinoline-3-carboxylic acid?
The molecular weight of 1,4-Dihydro-6-fluoro-4-oxoquinoline-3-carboxylic acid is 207.03 g/mol.
Where can I buy 1,4-Dihydro-6-fluoro-4-oxoquinoline-3-carboxylic acid?
You can request a quote for 1,4-Dihydro-6-fluoro-4-oxoquinoline-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 1,4-Dihydro-6-fluoro-4-oxoquinoline-3-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 1,4-Dihydro-6-fluoro-4-oxoquinoline-3-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.