Formula |
C20H21FN6O5 |
IUPAC Name |
n-[1-[4-[(4-fluorophenyl)methylcarbamoyl]-5-hydroxy-1-methyl-6-oxo-pyrimidin-2-yl]-1-methyl-ethyl]-5-methyl-1,3,4-oxadiazole-2-carboxamide |
Molecular Mass |
444.416 g·mol−1 |
Heat of Formation |
-639.5 ± 16.7 kJ·mol−1 |
Dipole Moment |
7.02 ± 1.08 D |
Volume |
499.3 Å 3 |
Surface Area |
426.54 Å 2 |
HOMO Energy |
-9.36 ± 0.55 eV |
LUMO Energy |
1.81 ± eV |
Point Group Symmetry |
C1
|
InChIKey |
CZFFBEXEKNGXKS-UHFFFAOYSA-N |
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Elements |
H
C
N
O
F
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