Gsk-189,254

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Formula C21H25N3O2
IUPAC Name 6-[[(3r)-3-cyclobutyl-1,2,4,5-tetrahydro-3-benzazepin-7-yl]oxy]-n-methyl-pyridine-3-carboxamide
Molecular Mass 351.442 g·mol−1
Heat of Formation -81.8 ± 16.7 kJ·mol−1
Dipole Moment 3.97 ± 1.08 D
Volume 433.62 Å 3
Surface Area 386.71 Å 2
HOMO Energy -8.85 ± 0.55 eV
LUMO Energy -0.55 ± eV
Point Group Symmetry C1
Synonyms
  • 6-[(3-cyclobutyl-1,2,4,5-tetrahydro-3-benzazepin-8-yl)oxy]-n-methyl-3-pyridinecarboxamide
  • 6-[(3-cyclobutyl-1,2,4,5-tetrahydro-3-benzazepin-8-yl)oxy]-n-methyl-nicotinamide
  • 6-[(3-cyclobutyl-1,2,4,5-tetrahydro-3-benzazepin-8-yl)oxy]-n-methyl-pyridine-3-carboxamide
  • 6-[(3-cyclobutyl-1,2,4,5-tetrahydro-3-benzazepin-8-yl)oxy]-n-methylpyridine-3-carboxamide
InChIKey WROHEWWOCPRMIA-UHFFFAOYSA-N
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