1-Cyclopropyl-7-(3,5-dimethylpiperazin-1-yl)-5,6,8-trifluoro-4-oxo-1,4-dihydroquinoline-3-carboxylic acid

• Catalog: OFC119354108
• CAS: 119354-10-8
• Category: Fluorinated Quinolines
• Synonyms: 3-Quinolinecarboxylic acid, 1-cyclopropyl-7-(3,5-dimethyl-1-piperazinyl)-5,6,8-trifluoro-1,4-dihydro-4-oxo-
• Purity: 97%

• IUPAC Name: 1-cyclopropyl-7-(3,5-dimethylpiperazin-1-yl)-5,6,8-trifluoro-4-oxoquinoline-3-carboxylic acid
• InChI: InChI=1S/C19H20F3N3O3/c1-8-5-24(6-9(2)23-8)17-14(21)13(20)12-16(15(17)22)25(10-3-4-10)7-11(18(12)26)19(27)28/h7-10,23H,3-6H2,1-2H3,(H,27,28)
• InChI Key: QIPQASLPWJVQMH-UHFFFAOYSA-N
• Isomeric SMILES: CC1CN(CC(N1)C)C2=C(C3=C(C(=C2F)F)C(=O)C(=CN3C4CC4)C(=O)O)F

• Molecular Formula: C19H20F3N3O3
• Molecular Weight: 395.38

• XLogP3-AA: 0.9
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 9
• Rotatable Bond Count: 3
• Exact Mass: 395.14567599 g/mol
• Monoisotopic Mass: 395.14567599 g/mol
• Topological Polar Surface Area: 72.9Ų
• Heavy Atom Count: 28
• Formal Charge: 0
• Complexity: 691