7-Fluoro-8-[4-(4-Fluorophenyl)-1-Piperazinyl]-1-Methyl-4-Oxo-1,4-Dihydrobenzo[B][1,8]Naphthyridine-3-Carboxylic Acid

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Properties Simple | Detailed

Formula C24H21F2N4O3+
IUPAC Name 7-fluoro-8-[4-(4-fluorophenyl)piperazin-1-yl]-1-methyl-4-oxo-benzo[b][1,8]naphthyridin-1-ium-3-ide-3-carboxylic acid
Molecular Mass 451.445 g·mol−1
Heat of Formation -76.2 ± 16.7 kJ·mol−1
Dipole Moment 1.87 ± 1.08 D
Volume 477.46 Å 3
Surface Area 413.97 Å 2
HOMO Energy -8.55 ± 0.55 eV
LUMO Energy -1.49 ± eV
Point Group Symmetry C1
Synonyms
  • 7-fluoro-8-[4-(4-fluorophenyl)-1-piperazinyl]-1-methyl-4-oxo-3-pyrido[6,5-b]quinolinecarboxylic acid
  • 7-fluoro-8-[4-(4-fluorophenyl)piperazin-1-yl]-1-methyl-4-oxo-pyrido[6,5-b]quinoline-3-carboxylic acid
  • 7-fluoro-8-[4-(4-fluorophenyl)piperazin-1-yl]-1-methyl-4-oxopyrido[6,5-b]quinoline-3-carboxylic acid
  • 7-fluoro-8-[4-(4-fluorophenyl)piperazin-1-yl]-4-keto-1-methyl-pyrido[6,5-b]quinoline-3-carboxylic acid
  • 7-fluoro-8-[4-(4-fluorophenyl)piperazinyl]-1-methyl-4-oxohydropyridino[2,3-b]quinoline-3-carboxylic acid
  • rp60556a
InChIKey YYHFVZLNDMSUBV-UHFFFAOYSA-N
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