Formula |
C16H20F2N6O4S |
IUPAC Name |
1-[2,6-difluoro-3-(propylsulfonylamino)phenyl]-3-[6-(2-hydroxyethylamino)pyrimidin-4-yl]urea |
Molecular Mass |
430.430 g·mol−1 |
Heat of Formation |
-852.7 ± 16.7 kJ·mol−1 |
Dipole Moment |
5.11 ± 1.08 D |
Volume |
464.88 Å 3 |
Surface Area |
407.31 Å 2 |
HOMO Energy |
-9.12 ± 0.55 eV |
LUMO Energy |
-0.95 ± eV |
Point Group Symmetry |
C1
|
InChIKey |
RFXIGXFNQUUTSZ-UHFFFAOYSA-N |
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Elements |
C
F
H
O
N
S
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