N-[(2S,3S)-4-{(4R)-4-[(2,2-Dimethylpropyl)Carbamoyl]-5,5-Dimethyl-1,3-Thiazolidin-3-Yl}-3-Hydroxy-4-Oxo-1-Phenyl-2-Butanyl]-N~2~-{(2S)-2-[(Methoxycarbonyl)Amino]-2-Phenylacetyl}-3-Methyl-L-Valinamide

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Properties Simple | Detailed

Formula C37H53N5O7S
IUPAC Name methyl n-[(1s)-2-[[(1s)-1-[[(1s,2s)-1-benzyl-3-[(4r)-4-(2,2-dimethylpropylcarbamoyl)-5,5-dimethyl-thiazolidin-3-yl]-2-hydroxy-3-oxo-propyl]carbamoyl]-2,2-dimethyl-propyl]amino]-2-oxo-1-phenyl-ethyl]carbamate
Molecular Mass 711.911 g·mol−1
Heat of Formation -1395.6 ± 16.7 kJ·mol−1
Dipole Moment 5.92 ± 1.08 D
Volume 881.79 Å 3
Surface Area 605.1 Å 2
HOMO Energy -8.43 ± 0.55 eV
LUMO Energy -0.35 ± eV
Point Group Symmetry C1
InChIKey BNMOFZILPSBXGG-OTJWULCMSA-N
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