Formula |
C28H34FN7O3 |
IUPAC Name |
[2-[5-[2-(cyclopropylmethylamino)pyrimidin-4-yl]-4-(4-fluorophenyl)-1h-imidazol-2-yl]-5-methyl-1,3-dioxan-5-yl]-(4-methylpiperazin-1-yl)methanone |
Molecular Mass |
535.613 g·mol−1 |
Heat of Formation |
-236.5 ± 16.7 kJ·mol−1 |
Dipole Moment |
0.50 ± 1.08 D |
Volume |
632.85 Å 3 |
Surface Area |
504.79 Å 2 |
HOMO Energy |
-8.91 ± 0.55 eV |
LUMO Energy |
2.19 ± eV |
Point Group Symmetry |
C1
|
InChIKey |
LHVMOVISOAUTPX-FCMXBYMOSA-N |
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Elements |
H
C
N
O
F
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