2-[3-{[2,2-Difluoro-2-(2-Pyridinyl)Ethyl]Amino}-6-Methyl-2-Oxo-1(2H)-Pyrazinyl]-N-[(3-Fluoro-2-Pyridinyl)Methyl]Acetamide

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Properties Simple | Detailed

Formula C20H19F3N6O2
IUPAC Name 2-[3-[[2,2-difluoro-2-(2-pyridyl)ethyl]amino]-6-methyl-2-oxo-pyrazin-1-yl]-n-[(3-fluoro-2-pyridyl)methyl]acetamide
Molecular Mass 432.399 g·mol−1
Heat of Formation -581.0 ± 16.7 kJ·mol−1
Dipole Moment 2.31 ± 1.08 D
Volume 472.25 Å 3
Surface Area 418.81 Å 2
HOMO Energy -8.31 ± 0.55 eV
LUMO Energy -0.80 ± eV
Point Group Symmetry C1
Synonyms
  • 2-(6-chloro-3-{[2,2-difluoro-2-(2-pyridinyl)ethyl]amino}-2-oxo-1(2h)-pyrazinyl)-n-[(2-fluoro-6-pyridinyl)methyl]acetamide
  • 2-[3-[(2,2-difluoro-2-pyridin-2-yl-ethyl)amino]-6-methyl-2-oxo-pyrazin-1-yl]-n-[(3-fluoropyridin-2-yl)methyl]ethanamide
  • 2-[3-[[2,2-difluoro-2-(2-pyridyl)ethyl]amino]-2-keto-6-methyl-pyrazin-1-yl]-n-[(3-fluoro-2-pyridyl)methyl]acetamide
  • 2-[3-[[2,2-difluoro-2-(2-pyridyl)ethyl]amino]-6-methyl-2-oxo-1-pyrazinyl]-n-[(3-fluoro-2-pyridyl)methyl]acetamide
  • 2-[3-[[2,2-difluoro-2-(2-pyridyl)ethyl]amino]-6-methyl-2-oxo-pyrazin-1-yl]-n-[(3-fluoro-2-pyridyl)methyl]acetamide
InChIKey JXHWVKOKYDAROD-UHFFFAOYSA-N
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