(2S,4S,5S)-5-Amino-N-(3-Amino-2,2-Dimethyl-3-Oxopropyl)-6-[4-(2-Chlorophenyl)-2,2-Dimethyl-5-Oxo-1-Piperazinyl]-4-Hydroxy-2-Isopropylhexanamide

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Properties Simple | Detailed

Formula C26H42ClN5O4
IUPAC Name (2s,4s,5s)-5-amino-n-(3-amino-2,2-dimethyl-3-oxo-propyl)-6-[(1r)-4-(2-chlorophenyl)-2,2-dimethyl-5-oxo-piperazin-1-yl]-4-hydroxy-2-isopropyl-hexanamide
Molecular Mass 524.096 g·mol−1
Heat of Formation -886.0 ± 16.7 kJ·mol−1
Dipole Moment 7.52 ± 1.08 D
Volume 647.89 Å 3
Surface Area 513.86 Å 2
HOMO Energy -9.25 ± 0.55 eV
LUMO Energy -0.57 ± eV
Point Group Symmetry C1
InChIKey RBIIKVXVYVANCQ-CUWPLCDZSA-N
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