5-{6-[4-(1-Piperazinyl)Phenyl]Pyrazolo[1,5-A]Pyrimidin-3-Yl}Quinoline

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Properties Simple | Detailed

Formula C25H22N6
IUPAC Name 5-[6-(4-piperazin-1-ylphenyl)pyrazolo[1,5-a]pyrimidin-3-yl]quinoline
Molecular Mass 406.482 g·mol−1
Heat of Formation 710.4 ± 16.7 kJ·mol−1
Dipole Moment 7.40 ± 1.08 D
Volume 478.72 Å 3
Surface Area 421.76 Å 2
HOMO Energy -8.49 ± 0.55 eV
LUMO Energy 1.02 ± eV
Point Group Symmetry C1
InChIKey BBDGBGOVJPEFBT-UHFFFAOYSA-N
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Elements H C N