5-[(3As,4S,6Ar)-2-Oxo-1,3,3A,4,6,6A-Hexahydrothieno[3,4-D]Imidazol-4-Yl]-N-[4-[(1,4-Dioxophthalazine-2,3-Diium-6-Yl)-Ethyl-Amino]Butyl]Pentanamide

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Properties Simple | Detailed

Formula C24H34N6O4S++
IUPAC Name 5-[(3as,4s,6ar)-2-oxo-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl]-n-[4-[(1,4-dioxo-2,3-dihydrophthalazin-6-yl)-ethyl-amino]butyl]pentanamide
Molecular Mass 502.630 g·mol−1
Heat of Formation -663.0 ± 16.7 kJ·mol−1
Dipole Moment 7.04 ± 1.08 D
Volume 596.22 Å 3
Surface Area 404.32 Å 2
HOMO Energy -8.47 ± 0.55 eV
LUMO Energy 2.99 ± eV
Point Group Symmetry C1
InChIKey TUOYUKJYOJHYCI-ZJOUEHCJSA-N
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