5-[(1R)-3-Amino-4-Fluoro-1-{3-[5-(1-Propyn-1-Yl)-3-Pyridinyl]Phenyl}-1H-Isoindol-1-Yl]-1-Ethyl-3-Methyl-2(1H)-Pyridinone

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Properties Simple | Detailed

Formula C30H25FN4O+
IUPAC Name 5-[(1r)-3-amino-4-fluoro-1-[3-(5-prop-1-ynyl-3-pyridyl)phenyl]isoindol-1-yl]-1-ethyl-3-methyl-pyridin-2-one
Molecular Mass 476.544 g·mol−1
Heat of Formation 308.5 ± 16.7 kJ·mol−1
Dipole Moment 4.44 ± 1.08 D
Volume 565.68 Å 3
Surface Area 486.56 Å 2
HOMO Energy -8.52 ± 0.55 eV
LUMO Energy -0.90 ± eV
Point Group Symmetry C1
InChIKey TUGLMYZSOPKJOA-PMERELPUSA-N
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