| Formula |
C29H35FN8O |
| IUPAC Name |
[4-[[2-[(4-aminocyclohexyl)amino]-9-(3-fluorophenyl)purin-6-yl]amino]phenyl]-piperidin-1-ylmethanone |
| Molecular Mass |
530.640 g·mol−1 |
| Heat of Formation |
11.4 ± 16.7 kJ·mol−1 |
| Dipole Moment |
3.17 ± 1.08 D |
| Volume |
635.06 Å 3 |
| Surface Area |
503.38 Å 2 |
| HOMO Energy |
-8.54 ± 0.55 eV |
| LUMO Energy |
-0.71 ± eV |
| Point Group Symmetry |
C1
|
| InChIKey |
KRCOMOOXOZSNAJ-AFARHQOCSA-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
F
O
N
|
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