5-Chloro-1-{1-[4-(4-Fluorophenyl)-4-Oxobutyl]-4-Piperidinyl}-1,3-Dihydro-2H-Benzimidazol-2-One

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Properties Simple | Detailed

Formula C22H23ClFN3O2
IUPAC Name 5-chloro-1-[1-[4-(4-fluorophenyl)-4-oxo-butyl]-4-piperidyl]benzimidazole-1,3-diium-2-one
Molecular Mass 415.888 g·mol−1
Heat of Formation -363.9 ± 16.7 kJ·mol−1
Dipole Moment 3.68 ± 1.08 D
Volume 479.9 Å 3
Surface Area 412.65 Å 2
HOMO Energy -8.89 ± 0.55 eV
LUMO Energy -0.66 ± eV
Point Group Symmetry C1
Synonyms
  • 2h-benzimidazol-2-one, 5-chloro-1-(1-(4-(4-fluorophenyl)-4-oxobutyl)-4-piperidinyl)-1,3-dihydro-
  • 6-chloro-3-[1-[4-(4-fluorophenyl)-4-keto-butyl]-4-piperidyl]-1h-benzimidazol-2-one
  • 6-chloro-3-[1-[4-(4-fluorophenyl)-4-oxo-butyl]-4-piperidyl]-1h-benzimidazol-2-one
  • 6-chloro-3-[1-[4-(4-fluorophenyl)-4-oxo-butyl]piperidin-4-yl]-1h-benzimidazol-2-one
  • 6-chloro-3-[1-[4-(4-fluorophenyl)-4-oxobutyl]-4-piperidinyl]-1h-benzimidazol-2-one
  • 6-chloro-3-[1-[4-(4-fluorophenyl)-4-oxobutyl]piperidin-4-yl]-1h-benzimidazol-2-one
  • r 29800
CAS Number(s)
  • 64497-90-1
InChIKey FDMOTSHBFPEILA-UHFFFAOYSA-N
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