9-Amino-2-[2-(Dimethylamino)Ethyl]-6-{[2-(Dimethylamino)Ethyl]Amino}-1H,7H-Pyrimido[5,6,1-De]Acridine-1,3,7(2H)-Trione

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Formula C23H28N6O3
IUPAC Name 5-amino-15-[2-(dimethylamino)ethyl]-10-[2-(dimethylamino)ethylamino]-1,15-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-2(7),3,5,9,11,13(17)-hexaene-8,14,16-trione
Molecular Mass 436.507 g·mol−1
Heat of Formation -305.9 ± 16.7 kJ·mol−1
Dipole Moment 6.29 ± 1.08 D
Volume 513.15 Å 3
Surface Area 447.32 Å 2
HOMO Energy -8.30 ± 0.55 eV
LUMO Energy -1.11 ± eV
Point Group Symmetry C1
Synonyms
  • 9-amino-2-(2-(dimethylamino)ethyl)-6-((2-(dimethylamino)ethyl)amino)-1h,7h-pyrimido[5,6,1-de]acridine-1,3,7(2h)-trione
InChIKey HVGHXUABOZQFRM-UHFFFAOYSA-N
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