Formula |
C26H28F3N5O7S |
IUPAC Name |
(2r)-4-(2,6-dimethoxypyrimidin-4-yl)-n-[(4-methoxyphenyl)methyl]-1-[4-(trifluoromethoxy)phenyl]sulfonyl-piperazine-2-carboxamide |
Molecular Mass |
611.590 g·mol−1 |
Heat of Formation |
-1476.0 ± 16.7 kJ·mol−1 |
Dipole Moment |
4.74 ± 1.08 D |
Volume |
650.57 Å 3 |
Surface Area |
532.71 Å 2 |
HOMO Energy |
-8.89 ± 0.55 eV |
LUMO Energy |
-1.31 ± eV |
Point Group Symmetry |
C1
|
InChIKey |
KPMIAKLULQWSOC-OAQYLSRUSA-N |
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Links |
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Downloads |
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Elements |
C
F
H
O
N
S
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