5-((3-Cyclobutyl-2,3,4,5-Tetrahydro-1H-3-Benzazepin-7-Yl)Oxy)-N-Methyl-2-Pyrazinecarboxamide

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Formula C20H24N4O2
IUPAC Name 5-[[(3r)-3-cyclobutyl-1,2,4,5-tetrahydro-3-benzazepin-7-yl]oxy]-n-methyl-pyrazine-2-carboxamide
Molecular Mass 352.430 g·mol−1
Heat of Formation -24.2 ± 16.7 kJ·mol−1
Dipole Moment 1.42 ± 1.08 D
Volume 429.47 Å 3
Surface Area 384.91 Å 2
HOMO Energy -8.85 ± 0.55 eV
LUMO Energy -0.91 ± eV
Point Group Symmetry C1
Synonyms
  • 5-[(3-cyclobutyl-1,2,4,5-tetrahydro-3-benzazepin-8-yl)oxy]-n-methyl-2-pyrazinecarboxamide
  • 5-[(3-cyclobutyl-1,2,4,5-tetrahydro-3-benzazepin-8-yl)oxy]-n-methyl-pyrazinamide
  • 5-[(3-cyclobutyl-1,2,4,5-tetrahydro-3-benzazepin-8-yl)oxy]-n-methyl-pyrazine-2-carboxamide
  • 5-[(3-cyclobutyl-1,2,4,5-tetrahydro-3-benzazepin-8-yl)oxy]-n-methylpyrazine-2-carboxamide
InChIKey DGWKVXVCPCPOAK-UHFFFAOYSA-N
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