Formula |
C18H23N7O3S |
IUPAC Name |
n,1-dimethyl-8-[(1-methylsulfonyl-4-piperidyl)amino]pyrazolo[4,3-h]quinazoline-3-carboxamide |
Molecular Mass |
417.485 g·mol−1 |
Heat of Formation |
-177.8 ± 16.7 kJ·mol−1 |
Dipole Moment |
6.23 ± 1.08 D |
Volume |
464.5 Å 3 |
Surface Area |
410.51 Å 2 |
HOMO Energy |
-8.37 ± 0.55 eV |
LUMO Energy |
-1.06 ± eV |
Point Group Symmetry |
C1
|
InChIKey |
MIDIIMBLQHSLFO-UHFFFAOYSA-N |
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Elements |
H
C
S
O
N
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