N~2~-(1-Cyclopentyl-4-Oxo-4,7-Dihydro-1H-Pyrazolo[3,4-D]Pyrimidin-6-Yl)-N-(4-Methoxyphenyl)-D-Alaninamide

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Formula C20H24N6O3
IUPAC Name (2r)-2-[(1-cyclopentyl-4-oxo-3,7-dihydropyrazolo[3,4-d]pyrimidine-2,3,3a,5,6,7a-hexaid-6-yl)amino]-n-(4-methoxyphenyl)propanamide
Molecular Mass 396.443 g·mol−1
Heat of Formation 3126.7 ± 16.7 kJ·mol−1
Dipole Moment 8.12 ± 1.08 D
Volume 419.76 Å 3
Surface Area 335.92 Å 2
HOMO Energy -10.15 ± 0.55 eV
LUMO Energy -3.21 ± eV
Point Group Symmetry C1
InChIKey UBBCZBKJYNXHGT-GFCCVEGCSA-N
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