Danofloxacin

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Formula C19H20FN3O3
IUPAC Name 1-cyclopropyl-6-fluoro-7-[(1s,2r,4s,5r)-5-methyl-2,5-diazabicyclo[2.2.1]heptan-2-yl]-4-oxo-5,8-dihydro-2h-quinoline-2,3,4a,5,6,7,8,8a-octaide-3-carboxylic acid
Molecular Mass 357.379 g·mol−1
Heat of Formation -350.4 ± 16.7 kJ·mol−1
Dipole Moment 10.82 ± 1.08 D
Volume 405.27 Å 3
Surface Area 344.88 Å 2
HOMO Energy -8.69 ± 0.55 eV
LUMO Energy 2.25 ± eV
Point Group Symmetry C1
Synonyms
  • 1-cyclopropyl-6-fluoro-4-keto-7-[(1s,4s)-3-methyl-3,6-diazabicyclo[2.2.1]heptan-6-yl]quinoline-3-carboxylic acid
  • 1-cyclopropyl-6-fluoro-7-[(1s,4s)-3-methyl-3,6-diazabicyclo[2.2.1]heptan-6-yl]-4-oxo-3-quinolinecarboxylic acid
  • 1-cyclopropyl-6-fluoro-7-[(1s,4s)-3-methyl-3,6-diazabicyclo[2.2.1]heptan-6-yl]-4-oxo-quinoline-3-carboxylic acid
  • 1-cyclopropyl-6-fluoro-7-[(1s,4s)-3-methyl-3,6-diazabicyclo[2.2.1]heptan-6-yl]-4-oxoquinoline-3-carboxylic acid
  • 3-quinolinecarboxylic acid, 1-cyclopropyl-6-fluoro-1,4-dihydro-7-(5-methyl-2,5-diazabicyclo(2.2.1)hept-2-yl)-4-oxo-, (1s)-
CAS Number(s)
  • 112398-08-0
InChIKey QMLVECGLEOSESV-RYUDHWBXSA-N
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