Formula |
C31H32N6O3 |
IUPAC Name |
1-[4-[2-[[6-[4-[2-(dimethylamino)ethoxy]phenyl]furo[2,3-d]pyrimidin-4-yl]amino]ethyl]phenyl]-3-phenyl-urea |
Molecular Mass |
536.624 g·mol−1 |
Heat of Formation |
41.9 ± 16.7 kJ·mol−1 |
Dipole Moment |
2.61 ± 1.08 D |
Volume |
643.36 Å 3 |
Surface Area |
580.54 Å 2 |
HOMO Energy |
-8.31 ± 0.55 eV |
LUMO Energy |
2.28 ± eV |
Point Group Symmetry |
C1
|
InChIKey |
GJFJLQXYFZSVOD-UHFFFAOYSA-N |
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Elements |
H
C
O
N
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