1,3-dimethyl-8-(4-methylpiperazin-1-yl)-7-(2-oxo-2-phenylethyl)-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
1,3-dimethyl-8-(4-methylpiperazin-1-yl)-7-(2-oxo-2-phenylethyl)-3,7-dihydro-1H-purine-2,6-dione
1,3-dimethyl-8-(4-methylpiperazin-1-yl)-7-(2-oxo-2-phenylethyl)-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | 8012-6044 |
| Compound Name: | 1,3-dimethyl-8-(4-methylpiperazin-1-yl)-7-(2-oxo-2-phenylethyl)-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 396.45 |
| Molecular Formula: | C20 H24 N6 O3 |
| Smiles: | CN1CCN(CC1)c1nc2c(C(N(C)C(N2C)=O)=O)n1CC(c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.7394 |
| logD: | 0.1342 |
| logSw: | -2.0525 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 62.421 |
| InChI Key: | FSNAKVGEVZZKHK-UHFFFAOYSA-N |