4-(2-{[(3S,5S,7S)-Adamantan-1-Ylmethyl]Amino}Ethyl)-6-Amino-2-(Methylamino)-1,7-Dihydro-8H-Imidazo[4,5-G]Quinazolin-8-One

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Properties Simple | Detailed

Formula C23H41N7O
IUPAC Name 4-[2-(1-adamantylmethylamino)ethyl]-6-amino-2-(methylamino)-7,9-dihydro-1h-imidazo[4,5-g]quinazoline-2,3,3a,4,4a,5,6,8a,9,9a-decaid-8-one
Molecular Mass 431.618 g·mol−1
Heat of Formation -1.1 ± 16.7 kJ·mol−1
Dipole Moment 3.45 ± 1.08 D
Volume 505.25 Å 3
Surface Area 435.68 Å 2
HOMO Energy -8.40 ± 0.55 eV
LUMO Energy 2.27 ± eV
Point Group Symmetry C1
InChIKey HJDZMDZEUQKVPL-CAUGRDAOSA-N
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