7-[(3S)-3-(2-Amino-2-Propanyl)-1-Pyrrolidinyl]-1-Cyclopropyl-6-Fluoro-4-Oxo-1,4-Dihydro-1,8-Naphthyridine-3-Carboxylic Acid

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Properties Simple | Detailed

Formula C19H23FN4O3
IUPAC Name 7-[(4-amino-4-methyl-pentyl)-methyl-amino]-1-cyclopropyl-6-fluoro-4-oxo-1,8-naphthyridin-8-ium-4a-ide-3-carboxylic acid
Molecular Mass 374.409 g·mol−1
Heat of Formation -467.4 ± 16.7 kJ·mol−1
Dipole Moment 11.03 ± 1.08 D
Volume 440.61 Å 3
Surface Area 371.38 Å 2
HOMO Energy -8.65 ± 0.55 eV
LUMO Energy 2.22 ± eV
Point Group Symmetry C1
Synonyms
  • 7-[(3s)-3-(1-amino-1-methyl-ethyl)pyrrolidin-1-yl]-1-cyclopropyl-6-fluoro-4-keto-1,8-naphthyridine-3-carboxylic acid
  • 7-[(3s)-3-(1-amino-1-methyl-ethyl)pyrrolidin-1-yl]-1-cyclopropyl-6-fluoro-4-oxo-1,8-naphthyridine-3-carboxylic acid
  • 7-[(3s)-3-(1-amino-1-methylethyl)-1-pyrrolidinyl]-1-cyclopropyl-6-fluoro-4-oxo-1,8-naphthyridine-3-carboxylic acid
  • 7-[(3s)-3-(2-aminopropan-2-yl)pyrrolidin-1-yl]-1-cyclopropyl-6-fluoro-4-oxo-1,8-naphthyridine-3-carboxylic acid
InChIKey WZGKUGHHTACDTE-JTQLQIEISA-N
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