Formula |
C26H25F3N8O |
IUPAC Name |
1-[4-[[4-[(5-cyclopentyl-1h-pyrazol-3-yl)amino]pyrimidin-2-yl]amino]phenyl]-3-[3-(trifluoromethyl)phenyl]urea |
Molecular Mass |
522.525 g·mol−1 |
Heat of Formation |
-319.3 ± 16.7 kJ·mol−1 |
Dipole Moment |
5.04 ± 1.08 D |
Volume |
581.31 Å 3 |
Surface Area |
521.8 Å 2 |
HOMO Energy |
-8.42 ± 0.55 eV |
LUMO Energy |
2.34 ± eV |
Point Group Symmetry |
C1
|
InChIKey |
GBMIFBVLJSCVJT-UHFFFAOYSA-N |
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Elements |
H
C
F
O
N
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