Formula |
C32H37N7O3 |
IUPAC Name |
1-(2,4-dimethoxyphenyl)-3-(2,6-dimethylphenyl)-1-[6-[4-(4-methylpiperazin-1-yl)anilino]pyrimidin-4-yl]urea |
Molecular Mass |
567.681 g·mol−1 |
Heat of Formation |
-34.7 ± 16.7 kJ·mol−1 |
Dipole Moment |
7.88 ± 1.08 D |
Volume |
699.5 Å 3 |
Surface Area |
520.24 Å 2 |
HOMO Energy |
-8.40 ± 0.55 eV |
LUMO Energy |
2.80 ± eV |
Point Group Symmetry |
C1
|
InChIKey |
UYUHRKLITDJEHB-UHFFFAOYSA-N |
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Elements |
H
C
O
N
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