N-{3-[(3-{[(5-Chloro-2-Thienyl)Sulfonyl]Amino}-4-Methoxy-1H-Indazol-1-Yl)Methyl]Benzyl}-2-Hydroxy-2-Methylpropanamide

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Properties Simple | Detailed

Formula C24H25ClN4O5S2
IUPAC Name n-[[3-[[3-[(5-chloro-2-thienyl)sulfonylamino]-4-methoxy-indazol-1-ium-2-id-1-yl]methyl]phenyl]methyl]-2-hydroxy-2-methyl-propanamide
Molecular Mass 549.062 g·mol−1
Heat of Formation -498.9 ± 16.7 kJ·mol−1
Dipole Moment 7.66 ± 1.08 D
Volume 601.25 Å 3
Surface Area 464.09 Å 2
HOMO Energy -8.23 ± 0.55 eV
LUMO Energy -1.31 ± eV
Point Group Symmetry C1
InChIKey YTEVTHHGQMUPHC-UHFFFAOYSA-N
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