8-[(dibenzylamino)methyl]-7-(2-methoxyethyl)-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
8-[(dibenzylamino)methyl]-7-(2-methoxyethyl)-3-methyl-3,7-dihydro-1H-purine-2,6-dione
8-[(dibenzylamino)methyl]-7-(2-methoxyethyl)-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | C692-0441 |
| Compound Name: | 8-[(dibenzylamino)methyl]-7-(2-methoxyethyl)-3-methyl-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 433.51 |
| Molecular Formula: | C24 H27 N5 O3 |
| Smiles: | CN1C(NC(c2c1nc(CN(Cc1ccccc1)Cc1ccccc1)n2CCOC)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9323 |
| logD: | 2.9269 |
| logSw: | -3.3056 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.627 |
| InChI Key: | JNGIDZQTQMURIE-UHFFFAOYSA-N |