8-{[4-(diphenylmethyl)piperazin-1-yl]methyl}-7-(3-hydroxypropyl)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
8-{[4-(diphenylmethyl)piperazin-1-yl]methyl}-7-(3-hydroxypropyl)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
8-{[4-(diphenylmethyl)piperazin-1-yl]methyl}-7-(3-hydroxypropyl)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | C470-0617 |
| Compound Name: | 8-{[4-(diphenylmethyl)piperazin-1-yl]methyl}-7-(3-hydroxypropyl)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 502.62 |
| Molecular Formula: | C28 H34 N6 O3 |
| Smiles: | CN1C(c2c(nc(CN3CCN(CC3)C(c3ccccc3)c3ccccc3)n2CCCO)N(C)C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9258 |
| logD: | 2.889 |
| logSw: | -2.9081 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.88 |
| InChI Key: | RBRAHDXZMMVOLN-UHFFFAOYSA-N |