(2S)-2-{(3S)-3-Acetamido-3-[(2S)-2-Butanyl]-2-Oxo-1-Pyrrolidinyl}-N-{(2S,3R)-3-Hydroxy-4-[(3-Methoxybenzyl)Amino]-1-Phenyl-2-Butanyl}-4-Phenylbutanamide

Molecule SVG Image

Properties Simple | Detailed

Formula C38H50N4O5
IUPAC Name (2s)-2-[(3s)-3-acetamido-3-[(1s)-1-methylpropyl]-2-oxo-pyrrolidin-1-yl]-n-[(1s,2r)-1-benzyl-2-hydroxy-3-[(3-methoxyphenyl)methylamino]propyl]-4-phenyl-butanamide
Molecular Mass 642.827 g·mol−1
Heat of Formation -797.8 ± 16.7 kJ·mol−1
Dipole Moment 7.49 ± 1.08 D
Volume 821.19 Å 3
Surface Area 629.5 Å 2
HOMO Energy -9.17 ± 0.55 eV
LUMO Energy 2.90 ± eV
Point Group Symmetry C1
InChIKey SMPAHDBHYSCFQF-SXXDCNOLSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O N