N-{[(2S)-1-{[5-(4-Fluorophenyl)-2-Methyl-1,3-Thiazol-4-Yl]Carbonyl}-2-Piperidinyl]Methyl}-1-Benzofuran-4-Carboxamide

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Properties Simple | Detailed

Formula C26H25FN3O3S
IUPAC Name n-[[(2s)-1-[5-(4-fluorophenyl)-2-methyl-thiazol-3-ium-5-ide-4-carbonyl]-2-piperidyl]methyl]benzofuran-4-carboxamide
Molecular Mass 478.558 g·mol−1
Heat of Formation -347.4 ± 16.7 kJ·mol−1
Dipole Moment 3.66 ± 1.08 D
Volume 551.48 Å 3
Surface Area 410.55 Å 2
HOMO Energy -9.04 ± 0.55 eV
LUMO Energy 1.99 ± eV
Point Group Symmetry C1
InChIKey ZJXIUGNEAIHSBI-IBGZPJMESA-N
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