7-[(2-chlorophenyl)methyl]-8-{[2-(diethylamino)ethyl]amino}-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
7-[(2-chlorophenyl)methyl]-8-{[2-(diethylamino)ethyl]amino}-3-methyl-3,7-dihydro-1H-purine-2,6-dione
7-[(2-chlorophenyl)methyl]-8-{[2-(diethylamino)ethyl]amino}-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | 5228-0323 |
| Compound Name: | 7-[(2-chlorophenyl)methyl]-8-{[2-(diethylamino)ethyl]amino}-3-methyl-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 404.9 |
| Molecular Formula: | C19 H25 Cl N6 O2 |
| Smiles: | CCN(CC)CCNc1nc2c(C(NC(N2C)=O)=O)n1Cc1ccccc1[Cl] |
| Stereo: | ACHIRAL |
| logP: | 3.2241 |
| logD: | 0.1491 |
| logSw: | -3.5276 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 67.285 |
| InChI Key: | QBVBTPOOEZQVCN-UHFFFAOYSA-N |