5-[2-{[4-(Methylsulfonyl)-1-Piperazinyl]Methyl}-8-(4-Morpholinyl)Imidazo[1,2-A]Pyrazin-6-Yl]-2-Pyrimidinamine

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Formula C20H27N9O3S
IUPAC Name 5-[2-[(4-methylsulfonylpiperazin-1-yl)methyl]-8-morpholino-3h-imidazo[1,2-a]pyrazin-4-ium-3-ylium-6-yl]pyrimidin-2-amine
Molecular Mass 473.552 g·mol−1
Heat of Formation -16.5 ± 16.7 kJ·mol−1
Dipole Moment 6.79 ± 1.08 D
Volume 530.71 Å 3
Surface Area 456.87 Å 2
HOMO Energy -8.46 ± 0.55 eV
LUMO Energy 2.04 ± eV
Point Group Symmetry C1
InChIKey OHKDVDMWRKFZRB-UHFFFAOYSA-N
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