N-{[(5S)-3-{3-Fluoro-4-[6-(1-Methyl-1H-Tetrazol-5-Yl)-3-Pyridinyl]Phenyl}-2-Oxo-1,3-Oxazolidin-5-Yl]Methyl}Acetamide

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Properties Simple | Detailed

Formula C19H18FN7O3
IUPAC Name n-[[(5s)-3-[3-fluoro-4-[6-(1-methyl-3,4-diaza-1-azonia-2-azanidacyclopenta-3,5-dien-5-yl)-3-pyridyl]phenyl]-2-oxo-oxazolidin-5-yl]methyl]acetamide
Molecular Mass 411.390 g·mol−1
Heat of Formation -189.7 ± 16.7 kJ·mol−1
Dipole Moment 9.24 ± 1.08 D
Volume 454.59 Å 3
Surface Area 413.06 Å 2
HOMO Energy -9.38 ± 0.55 eV
LUMO Energy -1.35 ± eV
Point Group Symmetry C1
Synonyms
  • da-7867
  • n-[[(5s)-3-[3-fluoro-4-[6-(1-methyl-1,2,3,4-tetrazol-5-yl)pyridin-3-yl]phenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl]ethanamide
  • n-[[(5s)-3-[3-fluoro-4-[6-(1-methyl-5-tetrazolyl)-3-pyridyl]phenyl]-2-oxo-5-oxazolidinyl]methyl]acetamide
  • n-[[(5s)-3-[3-fluoro-4-[6-(1-methyltetrazol-5-yl)-3-pyridyl]phenyl]-2-keto-oxazolidin-5-yl]methyl]acetamide
  • n-[[(5s)-3-[3-fluoro-4-[6-(1-methyltetrazol-5-yl)-3-pyridyl]phenyl]-2-oxo-oxazolidin-5-yl]methyl]acetamide
  • n-[[(5s)-3-[3-fluoro-4-[6-(1-methyltetrazol-5-yl)pyridin-3-yl]phenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl]acetamide
InChIKey XLLXHGCGAQJLLK-AWEZNQCLSA-N
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