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

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Properties Simple | Detailed

Formula C18H18FN4O3+
IUPAC Name 8-(3-amino-3-methyl-azetidin-1-yl)-7-fluoro-1-methyl-4-oxo-benzo[b][1,8]naphthyridin-1-ium-3-ide-3-carboxylic acid
Molecular Mass 357.359 g·mol−1
Heat of Formation -369.9 ± 16.7 kJ·mol−1
Dipole Moment 7.40 ± 1.08 D
Volume 394.79 Å 3
Surface Area 353.3 Å 2
HOMO Energy -8.87 ± 0.55 eV
LUMO Energy -1.40 ± eV
Point Group Symmetry C1
Synonyms
  • 8-(3-amino-3-methyl-1-azetidinyl)-7-fluoro-1-methyl-4-oxo-3-pyrido[6,5-b]quinolinecarboxylic acid
  • 8-(3-amino-3-methyl-azetidin-1-yl)-7-fluoro-1-methyl-4-oxo-pyrido[6,5-b]quinoline-3-carboxylic acid
  • 8-(3-amino-3-methyl-azetidin-1-yl)-7-fluoro-4-keto-1-methyl-pyrido[6,5-b]quinoline-3-carboxylic acid
  • 8-(3-amino-3-methylazetidin-1-yl)-7-fluoro-1-methyl-4-oxopyrido[6,5-b]quinoline-3-carboxylic acid
  • benzo(b)(1,8)naphthyridine-3-carboxylic acid, 8-(3-amino-3-methyl-1-azetidinyl)-7-fluoro-1,4-dihydro-1-methyl-4-oxo-
  • rpr-102341
CAS Number(s)
  • 149105-53-3
InChIKey DXXRUGBJXBQBCB-UHFFFAOYSA-N
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