4-Fluoro-N-(6-{[4-(2-Hydroxy-2-Propanyl)-1-Piperidinyl]Methyl}-1-[Cis-4-(Isopropylcarbamoyl)Cyclohexyl]-1H-Benzimidazol-2-Yl)Benzamide

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Properties Simple | Detailed

Formula C33H44FN5O3
IUPAC Name (ne)-4-fluoro-n-[6-[[4-(1-hydroxy-1-methyl-ethyl)-1-piperidyl]methyl]-1-[4-(isopropylcarbamoyl)cyclohexyl]benzimidazole-1,3-diium-2-ylidene]benzamide
Molecular Mass 577.733 g·mol−1
Heat of Formation -635.3 ± 16.7 kJ·mol−1
Dipole Moment 6.71 ± 1.08 D
Volume 717.24 Å 3
Surface Area 556.73 Å 2
HOMO Energy -8.71 ± 0.55 eV
LUMO Energy -0.81 ± eV
Point Group Symmetry C1
InChIKey WSTUJEXAPHIEIM-FEGDYQJNSA-N
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