| Formula |
C25H28N8O2 |
| IUPAC Name |
8-[(3r)-3-amino-1-piperidyl]-7-but-2-ynyl-3-methyl-1-[(4-methylquinazolin-2-yl)methyl]purine-2,6-dione |
| Molecular Mass |
472.542 g·mol−1 |
| Heat of Formation |
242.5 ± 16.7 kJ·mol−1 |
| Dipole Moment |
6.95 ± 1.08 D |
| Volume |
570.12 Å 3 |
| Surface Area |
465.91 Å 2 |
| HOMO Energy |
-8.47 ± 0.55 eV |
| LUMO Energy |
2.21 ± eV |
| Point Group Symmetry |
C1
|
| Synonyms
|
- 8-[(3r)-3-amino-1-piperidinyl]-7-but-2-ynyl-3-methyl-1-[(4-methyl-2-quinazolinyl)methyl]purine-2,6-dione
- 8-[(3r)-3-amino-1-piperidyl]-7-but-2-ynyl-3-methyl-1-[(4-methylquinazolin-2-yl)methyl]purine-2,6-dione
- 8-[(3r)-3-amino-1-piperidyl]-7-but-2-ynyl-3-methyl-1-[(4-methylquinazolin-2-yl)methyl]xanthine
|
| InChIKey |
LTXREWYXXSTFRX-QGZVFWFLSA-N |
| QR Code |
Generate QR Code |
| Links |
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|
| DOI |
|
| Downloads |
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|
| Elements |
H
C
O
N
|
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