5-[(1R,3S)-3-Aminocyclohexyl]-6-Bromo-3-(1-Methyl-1H-Pyrazol-4-Yl)Pyrazolo[1,5-A]Pyrimidin-7-Amine

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Formula C16H20BrN7
IUPAC Name 5-[(1r,3s)-3-aminocyclohexyl]-6-bromo-3-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidin-7-amine
Molecular Mass 390.281 g·mol−1
Heat of Formation 469.6 ± 16.7 kJ·mol−1
Dipole Moment 4.79 ± 1.08 D
Volume 404.95 Å 3
Surface Area 353.97 Å 2
HOMO Energy -8.06 ± 0.55 eV
LUMO Energy 1.39 ± eV
Point Group Symmetry C1
InChIKey CKLKHZYNDIKOOE-KOLCDFICSA-N
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Elements H C Br N