(8S)-9-[(5-Chloro-2-Thienyl)Methyl]-2-[(3R,5R)-3,5-Dimethyl-4-Morpholinyl]-8-(Trifluoromethyl)-6,7,8,9-Tetrahydro-4H-Pyrimido[1,2-A]Pyrimidin-4-One

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Properties Simple | Detailed

Formula C19H22ClF3N4O2S
IUPAC Name (2s)-1-[(5-chloro-2-thienyl)methyl]-8-[(3r,5r)-3,5-dimethylmorpholin-4-yl]-2-(trifluoromethyl)-3,4-dihydro-2h-pyrimido[1,2-a]pyrimidin-6-one
Molecular Mass 462.917 g·mol−1
Heat of Formation -815.2 ± 16.7 kJ·mol−1
Dipole Moment 3.29 ± 1.08 D
Volume 496.72 Å 3
Surface Area 384.59 Å 2
HOMO Energy -8.89 ± 0.55 eV
LUMO Energy -1.20 ± eV
Point Group Symmetry C1
InChIKey MMAAITOCOBQYBQ-BZPMIXESSA-N
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