N~1~,N~1~-Dibutyl-N~3~-{(2S,3R)-3-Hydroxy-4-[(3-Methoxybenzyl)Amino]-1-Phenyl-2-Butanyl}-1H-Indole-1,3-Dicarboxamide

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Properties Simple | Detailed

Formula C36H46N4O4
IUPAC Name n3-[(1s,2r)-1-benzyl-2-hydroxy-3-[(3-methoxyphenyl)methylamino]propyl]-n1,n1-dibutyl-indole-1,3-dicarboxamide
Molecular Mass 598.775 g·mol−1
Heat of Formation -507.2 ± 16.7 kJ·mol−1
Dipole Moment 6.45 ± 1.08 D
Volume 775.67 Å 3
Surface Area 599.84 Å 2
HOMO Energy -8.67 ± 0.55 eV
LUMO Energy 2.80 ± eV
Point Group Symmetry C1
InChIKey JPMPCSZOVMUPRZ-UZNNEEJFSA-N
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