Formula |
C19H23F4N7O5S |
IUPAC Name |
n-[(1s)-3-(5-fluoropyrimidin-2-yl)-1-[[4-[5-(2,2,2-trifluoroethoxy)pyrimidin-2-yl]piperazin-1-yl]sulfonylmethyl]propyl]-n-hydroxy-formamide |
Molecular Mass |
537.488 g·mol−1 |
Heat of Formation |
-1229.8 ± 16.7 kJ·mol−1 |
Dipole Moment |
4.58 ± 1.08 D |
Volume |
562.83 Å 3 |
Surface Area |
471.55 Å 2 |
HOMO Energy |
-8.83 ± 0.55 eV |
LUMO Energy |
-1.36 ± eV |
Point Group Symmetry |
C1
|
InChIKey |
BEMGDWJRAZUSRP-HNNXBMFYSA-N |
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Elements |
C
F
H
O
N
S
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