Formula |
C30H31F3N8O |
IUPAC Name |
4-[[(1s,3s)-3-(dimethylamino)pyrrolidin-1-yl]methyl]-n-[4-methyl-3-[(5-pyrimidin-5-ylpyrimidin-2-yl)amino]phenyl]-3-(trifluoromethyl)benzamide |
Molecular Mass |
576.615 g·mol−1 |
Heat of Formation |
-288.2 ± 16.7 kJ·mol−1 |
Dipole Moment |
7.90 ± 1.08 D |
Volume |
667.69 Å 3 |
Surface Area |
565.63 Å 2 |
HOMO Energy |
-8.64 ± 0.55 eV |
LUMO Energy |
-0.98 ± eV |
Point Group Symmetry |
C1
|
InChIKey |
ZOPBZHLJXQAQON-VWLOTQADSA-N |
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Links |
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Elements |
H
C
N
O
F
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