N-[(1R)-2-(4-Benzoyl-1-Piperidinyl)-2-Oxo-1-Phenylethyl]-3-Carbamimidoylbenzamide

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Properties Simple | Detailed

Formula C28H28N4O3
IUPAC Name n-[(1r)-2-(4-benzoyl-1-piperidyl)-2-oxo-1-phenyl-ethyl]-3-carbamimidoyl-benzamide
Molecular Mass 468.547 g·mol−1
Heat of Formation -142.4 ± 16.7 kJ·mol−1
Dipole Moment 4.14 ± 1.08 D
Volume 568.58 Å 3
Surface Area 476.49 Å 2
HOMO Energy -9.44 ± 0.55 eV
LUMO Energy -0.72 ± eV
Point Group Symmetry C1
Synonyms
  • 3-[(z)-amino(imino)methyl]-n-[2-(4-benzoyl-1-piperidinyl)-2-oxo-1-phenylethyl]benzamide
  • 3-amidino-n-[(1r)-2-[4-(benzoyl)-1-piperidyl]-2-keto-1-phenyl-ethyl]benzamide
  • 3-carbamimidoyl-n-[(1r)-2-oxo-1-phenyl-2-(4-phenylcarbonylpiperidin-1-yl)ethyl]benzamide
  • 3-carbamimidoyl-n-[(1r)-2-oxo-2-[4-(oxo-phenylmethyl)-1-piperidinyl]-1-phenylethyl]benzamide
  • bpo
  • n-[(1r)-2-[4-(benzoyl)-1-piperidyl]-2-oxo-1-phenyl-ethyl]-3-carbamimidoyl-benzamide
  • n-[(1r)-2-[4-(benzoyl)piperidin-1-yl]-2-oxo-1-phenylethyl]-3-carbamimidoylbenzamide
InChIKey SEXVRUMCMJFNTJ-XMMPIXPASA-N
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