3-(6-{[4-(Trifluoromethoxy)Phenyl]Amino}-4-Pyrimidinyl)Benzamide

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Properties Simple | Detailed

Formula C18H13F3N4O2
IUPAC Name 3-[6-[4-(trifluoromethoxy)anilino]pyrimidin-4-yl]benzamide
Molecular Mass 374.317 g·mol−1
Heat of Formation -639.4 ± 16.7 kJ·mol−1
Dipole Moment 5.45 ± 1.08 D
Volume 399.38 Å 3
Surface Area 368.23 Å 2
HOMO Energy -9.17 ± 0.55 eV
LUMO Energy 1.87 ± eV
Point Group Symmetry C1
Synonyms
  • (3-(6)-(4-trifluoromethoxy-phenylamino)-pyrimidin-4-yl)-benzamide
  • 3-[6-(4-trifluoromethoxy-phenylamino)-pyrimidin-4-yl]-benzamide
  • 3-[6-[[4-(trifluoromethoxy)phenyl]amino]-4-pyrimidinyl]benzamide
  • bcr-abl inhibitor
  • gnf-2
InChIKey WEVYNIUIFUYDGI-UHFFFAOYSA-N
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