(2S)-2-[(3R)-3-Acetamido-3-Isobutyl-2-Oxo-1-Pyrrolidinyl]-N-{(1R,2S)-3-(3,5-Difluorophenyl)-1-Hydroxy-1-[(2R,4R)-4-Propoxy-2-Pyrrolidinyl]-2-Propanyl}-4-Phenylbutanamide

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Properties Simple | Detailed

Formula C36H50F2N4O5
IUPAC Name (2s)-2-[(3r)-3-acetamido-3-isobutyl-2-oxo-pyrrolidin-1-yl]-n-[(1s,2r)-1-[(3,5-difluorophenyl)methyl]-2-hydroxy-2-[(2r,4r)-4-propoxypyrrolidin-2-yl]ethyl]-4-phenyl-butanamide
Molecular Mass 656.803 g·mol−1
Heat of Formation -1333.5 ± 16.7 kJ·mol−1
Dipole Moment 10.76 ± 1.08 D
Volume 825.52 Å 3
Surface Area 633.35 Å 2
HOMO Energy -9.01 ± 0.55 eV
LUMO Energy -0.45 ± eV
Point Group Symmetry C1
InChIKey LPZOLMFQGUDKQH-ZXWXCOCLSA-N
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