8-(4-benzylpiperazin-1-yl)-1,3-dimethyl-7-(2-oxo-2-phenylethyl)-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
8-(4-benzylpiperazin-1-yl)-1,3-dimethyl-7-(2-oxo-2-phenylethyl)-3,7-dihydro-1H-purine-2,6-dione
8-(4-benzylpiperazin-1-yl)-1,3-dimethyl-7-(2-oxo-2-phenylethyl)-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | 8011-1953 |
| Compound Name: | 8-(4-benzylpiperazin-1-yl)-1,3-dimethyl-7-(2-oxo-2-phenylethyl)-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 472.55 |
| Molecular Formula: | C26 H28 N6 O3 |
| Smiles: | CN1C(c2c(nc(N3CCN(CC3)Cc3ccccc3)n2CC(c2ccccc2)=O)N(C)C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2377 |
| logD: | 2.5348 |
| logSw: | -3.3423 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 62.485 |
| InChI Key: | RXXBTALHSACIEO-UHFFFAOYSA-N |