N-[(2S)-2-[(1,4'-Bipiperidin-1'-Ylacetyl)Amino]-3-(1H-Indol-3-Yl)Propyl]-N-(2-Methoxybenzyl)Acetamide

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Properties Simple | Detailed

Formula C33H45N5O3
IUPAC Name n-[(1s)-1-[[acetyl-[(2-methoxyphenyl)methyl]amino]methyl]-2-(1h-indol-3-yl)ethyl]-2-[4-(1-piperidyl)-1-piperidyl]acetamide
Molecular Mass 559.742 g·mol−1
Heat of Formation -377.1 ± 16.7 kJ·mol−1
Dipole Moment 6.94 ± 1.08 D
Volume 709.7 Å 3
Surface Area 521.05 Å 2
HOMO Energy -8.57 ± 0.55 eV
LUMO Energy 2.70 ± eV
Point Group Symmetry C1
Synonyms
  • n-[(1s)-1-[[acetyl-[(2-methoxyphenyl)methyl]amino]methyl]-2-(1h-indol-3-yl)ethyl]-2-[4-(1-piperidyl)-1-piperidinyl]acetamide
  • n-[(2s)-1-[acetyl-[(2-methoxyphenyl)methyl]amino]-3-(1h-indol-3-yl)propan-2-yl]-2-(4-piperidin-1-ylpiperidin-1-yl)acetamide
InChIKey CVXJAPZTZWLRBP-NDEPHWFRSA-N
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