6-Fluoro-1-(4-Fluorophenyl)-4-Oxo-7-(1-Piperazinyl)-1,4-Dihydro-3-Cinnolinecarboxylic Acid

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Properties Simple | Detailed

Formula C19H24F2N4O3
IUPAC Name 6-fluoro-1-(4-fluorophenyl)-4-oxo-7-piperazin-1-yl-5,8-dihydrocinnoline-2,3,4a,5,6,7,8,8a-octaide-3-carboxylic acid
Molecular Mass 394.416 g·mol−1
Heat of Formation -435.5 ± 16.7 kJ·mol−1
Dipole Moment 6.88 ± 1.08 D
Volume 421.65 Å 3
Surface Area 365.91 Å 2
HOMO Energy -8.99 ± 0.55 eV
LUMO Energy -1.17 ± eV
Point Group Symmetry C1
Synonyms
  • 1-(4-fluorophenyl)-6-fluoro-1,4-dihydro-4-oxo-7-(1-piperazinyl)cinnoline-3-carboxylic acid
  • 6-fluoro-1-(4-fluorophenyl)-4-keto-7-piperazin-1-yl-cinnoline-3-carboxylic acid
  • 6-fluoro-1-(4-fluorophenyl)-4-oxo-7-(1-piperazinyl)-3-cinnolinecarboxylic acid
  • 6-fluoro-1-(4-fluorophenyl)-4-oxo-7-piperazin-1-yl-cinnoline-3-carboxylic acid
  • 6-fluoro-1-(4-fluorophenyl)-4-oxo-7-piperazin-1-ylcinnoline-3-carboxylic acid
  • fpfpcc
CAS Number(s)
  • 114610-10-5
InChIKey KXMZXXPBWSASJD-UHFFFAOYSA-N
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