2-(3-{1-[(1R)-1,2-Dihydro-1-Acenaphthylenyl]-4-Piperidinyl}-2-Oxo-2,3-Dihydro-1H-Benzimidazol-1-Yl)-N-Methylacetamide

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Properties Simple | Detailed

Formula C27H28N4O2
IUPAC Name 2-[3-[1-[(1r)-1,2-dihydroacenaphthylen-1-yl]-4-piperidyl]-2-oxo-benzimidazole-1,3-diium-1-yl]-n-methyl-acetamide
Molecular Mass 440.537 g·mol−1
Heat of Formation -22.1 ± 16.7 kJ·mol−1
Dipole Moment 3.73 ± 1.08 D
Volume 530.07 Å 3
Surface Area 441.5 Å 2
HOMO Energy -8.51 ± 0.55 eV
LUMO Energy -0.35 ± eV
Point Group Symmetry C1
Synonyms
  • 2-[3-[1-[(1r)-1-acenaphthenyl]-4-piperidinyl]-2-oxo-1-benzimidazolyl]-n-methylacetamide
  • 2-[3-[1-[(1r)-acenaphthen-1-yl]-4-piperidyl]-2-keto-benzimidazol-1-yl]-n-methyl-acetamide
  • 2-[3-[1-[(1r)-acenaphthen-1-yl]-4-piperidyl]-2-oxo-benzimidazol-1-yl]-n-methyl-acetamide
  • 2-[3-[1-[(1r)-acenaphthen-1-yl]piperidin-4-yl]-2-oxo-benzimidazol-1-yl]-n-methyl-ethanamide
  • 2-[3-[1-[(1r)-acenaphthen-1-yl]piperidin-4-yl]-2-oxobenzimidazol-1-yl]-n-methylacetamide
InChIKey PJANMOWVUZBDQF-XMMPIXPASA-N
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