| Formula |
C25H28ClN7O2 |
| IUPAC Name |
7-[[(2z,5s)-5-chloro-2-[2-methoxy-4-(4-methylpiperazin-1-yl)phenyl]imino-5h-pyrimidin-4-yl]amino]-2-methyl-isoindolin-1-one |
| Molecular Mass |
493.989 g·mol−1 |
| Heat of Formation |
166.3 ± 16.7 kJ·mol−1 |
| Dipole Moment |
6.70 ± 1.08 D |
| Volume |
570.85 Å 3 |
| Surface Area |
473.97 Å 2 |
| HOMO Energy |
-7.84 ± 0.55 eV |
| LUMO Energy |
-1.25 ± eV |
| Point Group Symmetry |
C1
|
| InChIKey |
YKRBTLCKGPASPO-SFHVURJKSA-N |
| QR Code |
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| Links |
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| DOI |
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| Downloads |
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|
| Elements |
H
C
Cl
O
N
|
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