N-[5-({5-[(4-Acetyl-1-Piperazinyl)Carbonyl]-4-Methoxy-2-Methylphenyl}Sulfanyl)-1,3-Thiazol-2-Yl]-4-({[(2S)-3,3-Dimethyl-2-Butanyl]Amino}Methyl)Benzamide

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Properties Simple | Detailed

Formula C32H41N5O4S2
IUPAC Name n-[5-[5-(4-acetylpiperazine-1-carbonyl)-4-methoxy-2-methyl-phenyl]sulfanylthiazol-2-yl]-4-[[[(1s)-1,2,2-trimethylpropyl]amino]methyl]benzamide
Molecular Mass 623.829 g·mol−1
Heat of Formation -508.3 ± 16.7 kJ·mol−1
Dipole Moment 10.41 ± 1.08 D
Volume 764.86 Å 3
Surface Area 577.35 Å 2
HOMO Energy -8.59 ± 0.55 eV
LUMO Energy 1.85 ± eV
Point Group Symmetry C1
InChIKey ZHXNIYGJAOPMSO-NRFANRHFSA-N
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