N-[(1S)-1-Cyclohexyl-2-{(2S)-2-[4-(1-Naphthyl)-1,3-Thiazol-2-Yl]-1-Pyrrolidinyl}-2-Oxoethyl]-N~2~-Methyl-L-Alaninamide

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Properties Simple | Detailed

Formula C29H36N4O2S
IUPAC Name (2s)-n-[(1s)-1-cyclohexyl-2-[(2s)-2-[4-(1-naphthyl)thiazol-2-yl]pyrrolidin-1-yl]-2-oxo-ethyl]-2-(methylamino)propanamide
Molecular Mass 504.687 g·mol−1
Heat of Formation -177.7 ± 16.7 kJ·mol−1
Dipole Moment 2.37 ± 1.08 D
Volume 629.84 Å 3
Surface Area 500.53 Å 2
HOMO Energy -8.79 ± 0.55 eV
LUMO Energy 2.44 ± eV
Point Group Symmetry C1
InChIKey OWHXKYSKEROHGU-CNVLFFCLSA-N
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