Methyl N-[1-[[[5-[[1-(Allylcarbamoyl)-2-Methyl-Propyl]Amino]-4-[(4-Allylphenyl)Methyl]-4-Hydroxy-5-Oxo-Pentyl]-[[4-(2H-Thiophen-5-Yl)Phenyl]Methyl]Amino]Carbamoyl]-2,2-Dimethyl-Propyl]Carbamate

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Properties Simple | Detailed

Formula C42H57N5O6S
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-(2h-thiophen-5-yl)phenyl]methyl]amino]carbamoyl]-2,2-dimethyl-propyl]carbamate
Molecular Mass 759.997 g·mol−1
Heat of Formation -667.5 ± 16.7 kJ·mol−1
Dipole Moment 7.55 ± 1.08 D
Volume 974.87 Å 3
Surface Area 660.35 Å 2
HOMO Energy -8.53 ± 0.55 eV
LUMO Energy -1.55 ± eV
Point Group Symmetry C1
InChIKey DXIOFNJEWRZYDH-FCSANXPSSA-N
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