Cis-4-Methyl-N-[(2S)-4-(Methylsulfanyl)-1-Oxo-1-(4-Pyridinylamino)-2-Butanyl]Cyclohexanecarboxamide

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Properties Simple | Detailed

Formula C18H27N3O2S
IUPAC Name 4-methyl-n-[(1s)-3-methylsulfanyl-1-(4-pyridylcarbamoyl)propyl]cyclohexanecarboxamide
Molecular Mass 349.491 g·mol−1
Heat of Formation -384.4 ± 16.7 kJ·mol−1
Dipole Moment 7.37 ± 1.08 D
Volume 393.12 Å 3
Surface Area 379.44 Å 2
HOMO Energy -8.72 ± 0.55 eV
LUMO Energy 2.84 ± eV
Point Group Symmetry C1
InChIKey OCZKGSPGDOPDAI-LZWOXQAQSA-N
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