Orbifloxacin

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Properties Simple | Detailed

Formula C19H20F3N3O3
IUPAC Name 1-cyclopropyl-7-[(3s,5r)-3,5-dimethylpiperazin-1-yl]-5,6,8-trifluoro-4-oxo-2h-quinoline-2,3,4a,5,6,7,8,8a-octaide-3-carboxylic acid
Molecular Mass 395.376 g·mol−1
Heat of Formation -514.0 ± 16.7 kJ·mol−1
Dipole Moment 42.84 ± 1.08 D
Volume 434.58 Å 3
Surface Area 369.68 Å 2
HOMO Energy -7.14 ± 0.55 eV
LUMO Energy -1.69 ± eV
Point Group Symmetry C1
Synonyms
  • 1-cyclopropyl-5,6,8-trifluoro-1,4-dihydro-7-(cis-3,5-dimethyl-1-piperazinyl)-4-oxo-quinoline-3-carboxylic acid
  • 1-cyclopropyl-7-(cis-3,5-dimethyl-1-piperazinyl)-5,6,8-trifluoro-1,4-dihydro-4-oxo-3-quinolinecarboxylic acid
  • 1-cyclopropyl-7-[(3s,5r)-3,5-dimethyl-1-piperazinyl]-5,6,8-trifluoro-4-oxo-3-quinolinecarboxylic acid
  • 1-cyclopropyl-7-[(3s,5r)-3,5-dimethylpiperazin-1-yl]-5,6,8-trifluoro-4-keto-quinoline-3-carboxylic acid
  • 1-cyclopropyl-7-[(3s,5r)-3,5-dimethylpiperazin-1-yl]-5,6,8-trifluoro-4-oxo-quinoline-3-carboxylic acid
  • 1-cyclopropyl-7-[(3s,5r)-3,5-dimethylpiperazin-1-yl]-5,6,8-trifluoro-4-oxoquinoline-3-carboxylic acid
  • bb_sc-2767
  • orbax
CAS Number(s)
  • 113617-63-3
InChIKey QIPQASLPWJVQMH-DTORHVGOSA-N
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