N~4~-(5-Cyclopropyl-1H-Pyrazol-3-Yl)-N~2~-(1H-Indazol-5-Yl)-6-Methyl-2,4-Pyrimidinediamine

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Properties Simple | Detailed

Formula C18H18N8
IUPAC Name n4-(5-cyclopropyl-1h-pyrazol-3-yl)-n2-(1h-indazol-5-yl)-6-methyl-pyrimidine-2,4-diamine
Molecular Mass 346.389 g·mol−1
Heat of Formation 679.3 ± 16.7 kJ·mol−1
Dipole Moment 3.65 ± 1.08 D
Volume 403.22 Å 3
Surface Area 375.13 Å 2
HOMO Energy -8.24 ± 0.55 eV
LUMO Energy 1.62 ± eV
Point Group Symmetry C1
InChIKey IUWCYHHHQACRIT-UHFFFAOYSA-N
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Elements H C N