(8S)-9-(2-Isopropoxyethyl)-2-(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 C17H25F3N4O3+
IUPAC Name (2s)-1-(2-isopropoxyethyl)-8-morpholino-2-(trifluoromethyl)-2,3,4,7-tetrahydropyrimido[1,2-a]pyrimidin-5-ium-7-id-6-one
Molecular Mass 390.401 g·mol−1
Heat of Formation -1123.8 ± 16.7 kJ·mol−1
Dipole Moment 4.50 ± 1.08 D
Volume 438.19 Å 3
Surface Area 355.91 Å 2
HOMO Energy -8.84 ± 0.55 eV
LUMO Energy 2.78 ± eV
Point Group Symmetry C1
InChIKey MYULDSNSZNSXKG-ZDUSSCGKSA-N
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