6-Difluoromethoxy-7-piperazinyl-3-quinolonecarboxylic acid
TL;DR: 6-Difluoromethoxy-7-piperazinyl-3-quinolonecarboxylic acid (CAS 121935-03-3) is a chemical compound with molecular formula C15H15F2N3O4 and molecular weight 339.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-(difluoromethoxy)-4-oxo-7-piperazin-1-yl-1H-quinoline-3-carboxylic acid
Also Known As: DFMPQ, 6-Difluoromethoxy-7-piperazinyl-3-quinolonecarboxylic acid, 6-(difluoromethoxy)-4-oxo-7-piperazin-1-yl-1H-quinoline-3-carboxylic acid, 6-(Difluoromethoxy)-4-oxo-7-(piperazin-1-yl)-1,4-dihydroquinoline-3-carboxylic acid, 3-Quinolinecarboxylicacid, 6-(difluoromethoxy)-1,4-dihydro-4-oxo-7-(1-piperazinyl)-
| Molecular Formula | C15H15F2N3O4 |
|---|---|
| Molecular Weight | 339.10 g/mol |
| LogP | 0.0 |
| Topological Polar Surface Area | 90.9 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 4 |
| Exact Mass | 339.10306 |
| Heavy Atoms | 24 |
| Complexity | 537.0 |
Chemical Identifiers
| CAS Number | 121935-03-3 |
|---|---|
| SMILES | C1CN(CCN1)C2=C(C=C3C(=C2)NC=C(C3=O)C(=O)O)OC(F)F |
| InChIKey | BWUZDTRHFMTIKP-UHFFFAOYSA-N |
Product Overview
6-Difluoromethoxy-7-piperazinyl-3-quinolonecarboxylic acid (CAS 121935-03-3), with molecular formula C15H15F2N3O4 and molecular weight 339.10 g/mol. IUPAC: 6-(difluoromethoxy)-4-oxo-7-piperazin-1-yl-1H-quinoline-3-carboxylic acid.
Chemical Property Profile of 6-Difluoromethoxy-7-piperazinyl-3-quinolonecarboxylic acid
Property Insights of 6-Difluoromethoxy-7-piperazinyl-3-quinolonecarboxylic acid
The XLogP value of 0.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-Difluoromethoxy-7-piperazinyl-3-quinolonecarboxylic acid. The TPSA of 90.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-Difluoromethoxy-7-piperazinyl-3-quinolonecarboxylic acid. Following Lipinski's Rule of Five, 6-Difluoromethoxy-7-piperazinyl-3-quinolonecarboxylic acid has 3 hydrogen bond donor(s) and 9 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-Difluoromethoxy-7-piperazinyl-3-quinolonecarboxylic acid?
The CAS number of 6-Difluoromethoxy-7-piperazinyl-3-quinolonecarboxylic acid is 121935-03-3.
What is the molecular formula of 6-Difluoromethoxy-7-piperazinyl-3-quinolonecarboxylic acid?
The molecular formula of 6-Difluoromethoxy-7-piperazinyl-3-quinolonecarboxylic acid is C15H15F2N3O4.
What is the molecular weight of 6-Difluoromethoxy-7-piperazinyl-3-quinolonecarboxylic acid?
The molecular weight of 6-Difluoromethoxy-7-piperazinyl-3-quinolonecarboxylic acid is 339.10 g/mol.
Where can I buy 6-Difluoromethoxy-7-piperazinyl-3-quinolonecarboxylic acid?
You can request a quote for 6-Difluoromethoxy-7-piperazinyl-3-quinolonecarboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-Difluoromethoxy-7-piperazinyl-3-quinolonecarboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 6-Difluoromethoxy-7-piperazinyl-3-quinolonecarboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.