Quinolone der.
TL;DR: Quinolone der. (CAS 164662-43-5) is a chemical compound with molecular formula C21H18F3N3O3 and molecular weight 417.13004 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(2,4-difluoro-3-methylphenyl)-6-fluoro-4-oxo-7-piperazin-1-ylquinoline-3-carboxylic acid
Also Known As: Quinolone der., 3-Quinolinecarboxylic acid, 1-(2,4-difluoro-3-methylphenyl)-6-fluoro-1,4-dihydro-4-oxo-7-(1-piperazinyl)-, 1-(2,4-difluoro-3-methylphenyl)-6-fluoro-4-oxo-7-(piperazin-1-yl)-1,4-dihydroquinoline-3-carboxylic acid, 1-(2,4-difluoro-3-methylphenyl)-6-fluoro-4-oxo-7-piperazin-1-ylquinoline-3-carboxylic acid, 1-(2,4-difluoro-3-methyl-phenyl)-6-fluoro-4-oxo-7-piperazin-1-yl-quinoline-3-carboxylic acid
Technical Specifications
| Molecular Formula | C21H18F3N3O3 |
| Molecular Weight | 417.13004 g/mol |
| XLogP | 0.7 |
| Topological Polar Surface Area (TPSA) | 72.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 3 |
| Exact Mass | 417.13004 Da |
| Heavy Atoms | 30 |
| Complexity | 715.0 |
| SMILES | CC1=C(C=CC(=C1F)N2C=C(C(=O)C3=CC(=C(C=C32)N4CCNCC4)F)C(=O)O)F |
| InChIKey | AEZHLKLKXDQVKH-UHFFFAOYSA-N |
Chemical Property Profile of Quinolone der.
Property Insights of Quinolone der.
The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Quinolone der.. The TPSA of 72.9 Ų falls within the moderate polarity range, balancing permeability and solubility for Quinolone der.. Following Lipinski's Rule of Five, Quinolone der. has 2 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Quinolone der.?
The CAS number of Quinolone der. is 164662-43-5.
What is the molecular formula of Quinolone der.?
The molecular formula of Quinolone der. is C21H18F3N3O3.
What is the molecular weight of Quinolone der.?
The molecular weight of Quinolone der. is 417.13004 g/mol.
Where can I buy Quinolone der.?
You can request a quote for Quinolone der. directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Quinolone der.?
Yes, CoreyChem provides custom synthesis services for Quinolone der. and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.