8-[4-(2-hydroxyethyl)piperazin-1-yl]-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
8-[4-(2-hydroxyethyl)piperazin-1-yl]-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
8-[4-(2-hydroxyethyl)piperazin-1-yl]-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | D226-0061 |
| Compound Name: | 8-[4-(2-hydroxyethyl)piperazin-1-yl]-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 308.34 |
| Molecular Formula: | C13 H20 N6 O3 |
| Smiles: | CN1C(c2c(nc([nH]2)N2CCN(CC2)CCO)N(C)C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | -0.1462 |
| logD: | -0.4991 |
| logSw: | -0.5017 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 75.9 |
| InChI Key: | MFMUXBMPMXPWAT-UHFFFAOYSA-N |