(4S,5S)-4-(3,4-Difluorophenyl)-N-{3-[4-(4-Fluorophenyl)-1-Piperidinyl]Propyl}-5-Methyl-2-Oxo-1,3-Oxazolidine-3-Carboxamide

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Properties Simple | Detailed

Formula C25H28F3N3O3
IUPAC Name (4s,5s)-4-(3,4-difluorophenyl)-n-[3-[4-(4-fluorophenyl)-1-piperidyl]propyl]-5-methyl-2-oxo-oxazolidine-3-carboxamide
Molecular Mass 475.503 g·mol−1
Heat of Formation -1002.7 ± 16.7 kJ·mol−1
Dipole Moment 2.14 ± 1.08 D
Volume 553.41 Å 3
Surface Area 424.71 Å 2
HOMO Energy -8.75 ± 0.55 eV
LUMO Energy 2.16 ± eV
Point Group Symmetry C1
Synonyms
  • (4s,5s)-4-(3,4-difluorophenyl)-n-[3-[4-(4-fluorophenyl)-1-piperidinyl]propyl]-5-methyl-2-oxo-3-oxazolidinecarboxamide
  • (4s,5s)-4-(3,4-difluorophenyl)-n-[3-[4-(4-fluorophenyl)-1-piperidyl]propyl]-2-keto-5-methyl-oxazolidine-3-carboxamide
  • (4s,5s)-4-(3,4-difluorophenyl)-n-[3-[4-(4-fluorophenyl)-1-piperidyl]propyl]-5-methyl-2-oxo-oxazolidine-3-carboxamide
InChIKey DTYAFBJXWWLRMA-QMHKHESXSA-N
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