Methyl [(2S)-1-{2-[(4R)-5-{[(2S)-1-(Allylamino)-3-Methyl-1-Oxo-2-Butanyl]Amino}-4-(4-Allylbenzyl)-4-Hydroxy-5-Oxopentyl]-2-[4-(4-Pyridinyl)Benzyl]Hydrazino}-3,3-Dimethyl-1-Oxo-2-Butanyl]Carbamate (Non -Preferred Name)

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Formula C43H58N6O6
IUPAC Name methyl n-[(1s)-1-[[[(4r)-5-[[(1s)-1-(allylcarbamoyl)-2-methyl-propyl]amino]-4-[(4-allylphenyl)methyl]-4-hydroxy-5-oxo-pentyl]-[[4-(4-pyridyl)phenyl]methyl]amino]carbamoyl]-2,2-dimethyl-propyl]carbamate
Molecular Mass 754.957 g·mol−1
Heat of Formation -921.0 ± 16.7 kJ·mol−1
Dipole Moment 5.36 ± 1.08 D
Volume 969.49 Å 3
Surface Area 662.59 Å 2
HOMO Energy -9.06 ± 0.55 eV
LUMO Energy -0.74 ± eV
Point Group Symmetry C1
InChIKey AZJLJLJSOQLYEA-COCJHVOVSA-N
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