Formula |
C23H30N6O4 |
IUPAC Name |
2-(5-amino-6-oxo-2-phenyl-pyrimidin-1-yl)-n-[(1r)-1-[(r)-(5-tert-butyl-1,3,4-oxadiazol-2-yl)-hydroxy-methyl]-2-methyl-propyl]acetamide |
Molecular Mass |
454.522 g·mol−1 |
Heat of Formation |
-482.0 ± 16.7 kJ·mol−1 |
Dipole Moment |
3.90 ± 1.08 D |
Volume |
551.8 Å 3 |
Surface Area |
403.72 Å 2 |
HOMO Energy |
-8.40 ± 0.55 eV |
LUMO Energy |
2.39 ± eV |
Point Group Symmetry |
C1
|
InChIKey |
HMPQTEPEMQZWQH-QZTJIDSGSA-N |
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Elements |
H
C
O
N
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