N-(4-Methyl-3-{[3-(4-Pyrimidinyl)-2-Pyridinyl]Amino}Phenyl)-3-(Trifluoromethyl)Benzamide

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Properties Simple | Detailed

Formula C24H18F3N5O
IUPAC Name n-[4-methyl-3-[(3-pyrimidin-4-yl-2-pyridyl)amino]phenyl]-3-(trifluoromethyl)benzamide
Molecular Mass 449.428 g·mol−1
Heat of Formation -353.7 ± 16.7 kJ·mol−1
Dipole Moment 3.41 ± 1.08 D
Volume 497.18 Å 3
Surface Area 437.96 Å 2
HOMO Energy -8.39 ± 0.55 eV
LUMO Energy 1.89 ± eV
Point Group Symmetry C1
Synonyms
  • muh
  • n-[4-methyl-3-[(3-pyrimidin-4-yl-2-pyridyl)amino]phenyl]-3-(trifluoromethyl)benzamide
  • n-[4-methyl-3-[(3-pyrimidin-4-ylpyridin-2-yl)amino]phenyl]-3-(trifluoromethyl)benzamide
  • n-[4-methyl-3-[[3-(4-pyrimidinyl)-2-pyridyl]amino]phenyl]-3-(trifluoromethyl)benzamide
InChIKey NESXBRNDMQUVNG-UHFFFAOYSA-N
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