N-[(2S)-1-{[(2R)-1-(Benzyloxy)-2-Cyano-2-Propanyl]Amino}-3-Cyclohexyl-1-Oxo-2-Propanyl]-4-Morpholinecarboxamide

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Properties Simple | Detailed

Formula C25H36N4O4
IUPAC Name n-[(1s)-2-[[(1r)-2-benzyloxy-1-cyano-1-methyl-ethyl]amino]-1-(cyclohexylmethyl)-2-oxo-ethyl]morpholine-4-carboxamide
Molecular Mass 456.578 g·mol−1
Heat of Formation -603.3 ± 16.7 kJ·mol−1
Dipole Moment 2.64 ± 1.08 D
Volume 580.77 Å 3
Surface Area 472.99 Å 2
HOMO Energy -9.35 ± 0.55 eV
LUMO Energy 0.06 ± eV
Point Group Symmetry C1
InChIKey MQWUTQCRGGBPBT-WIOPSUGQSA-N
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