7-Chloro-6-fluoro-4-oxo-1,4-dihydroquinoline-3-carboxylic acid, ethyl ester
TL;DR: 7-Chloro-6-fluoro-4-oxo-1,4-dihydroquinoline-3-carboxylic acid, ethyl ester (CAS 70458-93-4) is a chemical compound with molecular formula C12H9ClFNO3 and molecular weight 269.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 7-chloro-6-fluoro-4-oxo-1H-quinoline-3-carboxylate
Also Known As: Ethyl 7-chloro-6-fluoro-4-hydroxyquinoline-3-carboxylate, Norfloxacin Impurity 4, ethyl 7-chloro-6-fluoro-4-oxo-1,4-dihydroquinoline-3-carboxylate, Norfloxacin Impurity 42, Norfloxacin Impurity C18
| Molecular Formula | C12H9ClFNO3 |
|---|---|
| Molecular Weight | 269.03 g/mol |
| LogP | 2.4973 |
| Topological Polar Surface Area | 59.16 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 269.0255 |
| Heavy Atoms | 18 |
| Complexity | 680.81226 |
Chemical Identifiers
| CAS Number | 70458-93-4 |
|---|---|
| SMILES | CCOC(=O)C1=CNC2=CC(=C(C=C2C1=O)F)Cl |
Product Overview
7-Chloro-6-fluoro-4-oxo-1,4-dihydroquinoline-3-carboxylic acid, ethyl ester (CAS 70458-93-4), with molecular formula C12H9ClFNO3 and molecular weight 269.03 g/mol. IUPAC: ethyl 7-chloro-6-fluoro-4-oxo-1H-quinoline-3-carboxylate.
Chemical Property Profile of 7-Chloro-6-fluoro-4-oxo-1,4-dihydroquinoline-3-carboxylic acid, ethyl ester
Property Insights of 7-Chloro-6-fluoro-4-oxo-1,4-dihydroquinoline-3-carboxylic acid, ethyl ester
The XLogP value of 2.4973 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 7-Chloro-6-fluoro-4-oxo-1,4-dihydroquinoline-3-carboxylic acid, ethyl ester. With a topological polar surface area (TPSA) of 59.16 Ų, 7-Chloro-6-fluoro-4-oxo-1,4-dihydroquinoline-3-carboxylic acid, ethyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 7-Chloro-6-fluoro-4-oxo-1,4-dihydroquinoline-3-carboxylic acid, ethyl ester has 1 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 7-Chloro-6-fluoro-4-oxo-1,4-dihydroquinoline-3-carboxylic acid, ethyl ester?
The CAS number of 7-Chloro-6-fluoro-4-oxo-1,4-dihydroquinoline-3-carboxylic acid, ethyl ester is 70458-93-4.
What is the molecular formula of 7-Chloro-6-fluoro-4-oxo-1,4-dihydroquinoline-3-carboxylic acid, ethyl ester?
The molecular formula of 7-Chloro-6-fluoro-4-oxo-1,4-dihydroquinoline-3-carboxylic acid, ethyl ester is C12H9ClFNO3.
What is the molecular weight of 7-Chloro-6-fluoro-4-oxo-1,4-dihydroquinoline-3-carboxylic acid, ethyl ester?
The molecular weight of 7-Chloro-6-fluoro-4-oxo-1,4-dihydroquinoline-3-carboxylic acid, ethyl ester is 269.03 g/mol.
Where can I buy 7-Chloro-6-fluoro-4-oxo-1,4-dihydroquinoline-3-carboxylic acid, ethyl ester?
You can request a quote for 7-Chloro-6-fluoro-4-oxo-1,4-dihydroquinoline-3-carboxylic acid, ethyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 7-Chloro-6-fluoro-4-oxo-1,4-dihydroquinoline-3-carboxylic acid, ethyl ester?
Yes, KEHONG BIO provides custom synthesis services for 7-Chloro-6-fluoro-4-oxo-1,4-dihydroquinoline-3-carboxylic acid, ethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.