4-Methyl-3-({3-[2-(Methylamino)-4-Pyrimidinyl]-2-Pyridinyl}Oxy)-N-[2-(4-Morpholinyl)-5-(Trifluoromethyl)Phenyl]Benzamide

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Properties Simple | Detailed

Formula C29H27F3N6O3
IUPAC Name 4-methyl-3-[[3-[2-(methylamino)pyrimidin-4-yl]-2-pyridyl]oxy]-n-[2-morpholino-5-(trifluoromethyl)phenyl]benzamide
Molecular Mass 564.558 g·mol−1
Heat of Formation -702.6 ± 16.7 kJ·mol−1
Dipole Moment 7.39 ± 1.08 D
Volume 625.08 Å 3
Surface Area 463.16 Å 2
HOMO Energy -8.94 ± 0.55 eV
LUMO Energy 2.13 ± eV
Point Group Symmetry C1
Synonyms
  • 4-methyl-3-[3-(2-methylaminopyrimidin-4-yl)pyridin-2-yl]oxy-n-[2-morpholin-4-yl-5-(trifluoromethyl)phenyl]benzamide
  • 4-methyl-3-[[3-(2-methylamino-4-pyrimidinyl)-2-pyridyl]oxy]-n-[2-morpholino-5-(trifluoromethyl)phenyl]benzamide
  • 4-methyl-3-[[3-(2-methylaminopyrimidin-4-yl)-2-pyridyl]oxy]-n-[2-morpholino-5-(trifluoromethyl)phenyl]benzamide
  • mr9
InChIKey HHKWHHAJTWLRKG-UHFFFAOYSA-N
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