(1S)-4-Fluoro-1-[4-Fluoro-3-(5-Pyrimidinyl)Phenyl]-1-[2-(Trifluoromethyl)-4-Pyridinyl]-1H-Isoindol-3-Amine

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Properties Simple | Detailed

Formula C24H14F5N5
IUPAC Name (3s)-7-fluoro-3-(4-fluoro-3-pyrimidin-5-yl-phenyl)-3-[2-(trifluoromethyl)-4-pyridyl]isoindol-1-amine
Molecular Mass 467.393 g·mol−1
Heat of Formation -390.7 ± 16.7 kJ·mol−1
Dipole Moment 9.29 ± 1.08 D
Volume 487.53 Å 3
Surface Area 417.36 Å 2
HOMO Energy -9.80 ± 0.55 eV
LUMO Energy 1.69 ± eV
Point Group Symmetry C1
InChIKey UDQUVXUVXUGJFO-QHCPKHFHSA-N
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Elements H C N F