6-[(3S,4S)-1-Benzyl-4-Methyl-3-Pyrrolidinyl]-1-Isopropyl-1,5-Dihydro-4H-Pyrazolo[3,4-D]Pyrimidin-4-One

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Formula C20H31N5O
IUPAC Name 6-[(1s,3s,4s)-1-benzyl-4-methyl-pyrrolidin-3-yl]-1-isopropyl-3,5-dihydropyrazolo[3,4-d]pyrimidine-2,3,3a,6,7,7a-hexaid-4-one
Molecular Mass 357.493 g·mol−1
Heat of Formation 110.0 ± 16.7 kJ·mol−1
Dipole Moment 4.22 ± 1.08 D
Volume 439.8 Å 3
Surface Area 382.04 Å 2
HOMO Energy -9.17 ± 0.55 eV
LUMO Energy 2.49 ± eV
Point Group Symmetry C1
InChIKey PUGMRQMXTZPAIZ-RHSMWYFYSA-N
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