Formula |
C23H32N6O4S |
IUPAC Name |
5-[2-ethoxy-5-(4-ethylpiperazin-1-yl)sulfonyl-phenyl]-1-methyl-3-propyl-4h-pyrazolo[4,3-d]pyrimidin-7-one |
Molecular Mass |
488.603 g·mol−1 |
Heat of Formation |
-350.3 ± 16.7 kJ·mol−1 |
Dipole Moment |
10.63 ± 1.08 D |
Volume |
570.47 Å 3 |
Surface Area |
477.76 Å 2 |
HOMO Energy |
-8.77 ± 0.55 eV |
LUMO Energy |
-1.30 ± eV |
Point Group Symmetry |
C1
|
InChIKey |
MJEXYQIZUOHDGY-UHFFFAOYSA-N |
QR Code |
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Elements |
H
S
C
O
N
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