3-(6-Ethoxy-2-Naphthyl)-1-[(1-Methyl-4-Piperidyl)Methyl]Pyrazolo[3,4-D]Pyrimidin-4-Amine

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Formula C24H28N6O
IUPAC Name 3-(6-ethoxy-2-naphthyl)-1-[(1-methyl-4-piperidyl)methyl]pyrazolo[3,4-d]pyrimidin-1-ium-4-amine
Molecular Mass 416.519 g·mol−1
Heat of Formation 250.6 ± 16.7 kJ·mol−1
Dipole Moment 5.66 ± 1.08 D
Volume 505.81 Å 3
Surface Area 441.21 Å 2
HOMO Energy -8.57 ± 0.55 eV
LUMO Energy 2.22 ± eV
Point Group Symmetry C1
InChIKey KONPIFGGWNMOKY-UHFFFAOYSA-N
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