N-({3-[(5S)-1-(3-Chloro-4-Fluorobenzyl)-4-Hydroxy-5-(2-Methyl-2-Propanyl)-2-Oxo-2,5-Dihydro-1H-Pyrrol-3-Yl]-1,1-Dioxido-1,2-Benzothiazol-7-Yl}Methyl)Methanesulfonamide

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Properties Simple | Detailed

Formula C24H25ClFN3O6S2
IUPAC Name n-[[3-[(2s)-2-tert-butyl-1-[(3-chloro-4-fluoro-phenyl)methyl]-3-hydroxy-5-oxo-2h-pyrrol-4-yl]-1,1-dioxo-1,2-benzothiazol-7-yl]methyl]methanesulfonamide
Molecular Mass 570.053 g·mol−1
Heat of Formation -976.7 ± 16.7 kJ·mol−1
Dipole Moment 4.18 ± 1.08 D
Volume 605.17 Å 3
Surface Area 485.77 Å 2
HOMO Energy -9.88 ± 0.55 eV
LUMO Energy -1.43 ± eV
Point Group Symmetry C1
InChIKey OOHPVZYDADHCHM-JOCHJYFZSA-N
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