3-[7-(1H-Benzimidazol-5-Yl)-2-(4-Morpholinyl)-6,7-Dihydro-5H-Pyrrolo[2,3-D]Pyrimidin-4-Yl]Phenol

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Formula C23H22N6O2
IUPAC Name 3-[7-(3h-benzimidazol-5-yl)-2-morpholino-5,6-dihydropyrrolo[2,3-d]pyrimidin-4-yl]phenol
Molecular Mass 414.460 g·mol−1
Heat of Formation 172.2 ± 16.7 kJ·mol−1
Dipole Moment 6.32 ± 1.08 D
Volume 476.23 Å 3
Surface Area 406.3 Å 2
HOMO Energy -8.19 ± 0.55 eV
LUMO Energy 2.58 ± eV
Point Group Symmetry C1
InChIKey NBBUAPYZXMAOGM-UHFFFAOYSA-N
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