2-(2,6-Difluoro-4-Methoxyphenyl)-1-(4-{4-[(3-Methyl-1H-Pyrazol-5-Yl)Amino]Pyrrolo[2,1-F][1,2,4]Triazin-2-Yl}-1-Piperazinyl)Ethanone

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Properties Simple | Detailed

Formula C23H24F2N8O2
IUPAC Name 2-(2,6-difluoro-4-methoxyphenyl)-1-[4-[4-[(5-methyl-1h-pyrazol-3-yl)amino]pyrrolo[2,1-f][1,2,4]triazin-2-yl]piperazin-1-yl]ethanone
Molecular Mass 482.486 g·mol−1
Heat of Formation -122.2 ± 16.7 kJ·mol−1
Dipole Moment 1.41 ± 1.08 D
Volume 538.37 Å 3
Surface Area 460.12 Å 2
HOMO Energy -8.65 ± 0.55 eV
LUMO Energy -1.19 ± eV
Point Group Symmetry C1
InChIKey CFXACTJFCDMPJK-UHFFFAOYSA-N
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