1-Methyl-5-(2-{[5-(4-Methyl-1-Piperazinyl)-2-(Trifluoromethoxy)Phenyl]Amino}-4-Pyrimidinyl)-1H-Pyrrole-3-Carboxamide

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Formula C22H24F3N7O2
IUPAC Name 1-methyl-5-[2-[5-(4-methylpiperazin-1-yl)-2-(trifluoromethoxy)anilino]pyrimidin-4-yl]pyrrole-3-carboxamide
Molecular Mass 475.467 g·mol−1
Heat of Formation -602.1 ± 16.7 kJ·mol−1
Dipole Moment 3.87 ± 1.08 D
Volume 532.3 Å 3
Surface Area 456.04 Å 2
HOMO Energy -8.43 ± 0.55 eV
LUMO Energy 2.17 ± eV
Point Group Symmetry C1
InChIKey HGBZKLOZYQAERY-UHFFFAOYSA-N
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