4-[4-(5,5-Dimethyl-4,5-Dihydro-1,3-Thiazol-2-Yl)-1-Piperazinyl]-6-(2,2,2-Trifluoroethyl)Thieno[2,3-D]Pyrimidine

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Formula C17H20F3N5S2
IUPAC Name 4-[4-(5,5-dimethyl-4h-thiazol-2-yl)piperazin-1-yl]-6-(2,2,2-trifluoroethyl)thieno[2,3-d]pyrimidine
Molecular Mass 415.499 g·mol−1
Heat of Formation -422.2 ± 16.7 kJ·mol−1
Dipole Moment 5.25 ± 1.08 D
Volume 454.14 Å 3
Surface Area 383.36 Å 2
HOMO Energy -8.79 ± 0.55 eV
LUMO Energy 1.87 ± eV
Point Group Symmetry C1
InChIKey SFDROHXKTATJBI-UHFFFAOYSA-N
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Elements H C N S F