2-(8-{[4-(2-hydroxyethyl)piperazin-1-yl]methyl}-1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)acetamide
Chemical Structure Depiction of
2-(8-{[4-(2-hydroxyethyl)piperazin-1-yl]methyl}-1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)acetamide
2-(8-{[4-(2-hydroxyethyl)piperazin-1-yl]methyl}-1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)acetamide
Compound characteristics
| Compound ID: | C470-0514 |
| Compound Name: | 2-(8-{[4-(2-hydroxyethyl)piperazin-1-yl]methyl}-1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)acetamide |
| Molecular Weight: | 379.42 |
| Molecular Formula: | C16 H25 N7 O4 |
| Smiles: | CN1C(c2c(nc(CN3CCN(CC3)CCO)n2CC(N)=O)N(C)C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | -1.7147 |
| logD: | -2.0928 |
| logSw: | -0.0548 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 101.519 |
| InChI Key: | JEORNRXCKDKAIK-UHFFFAOYSA-N |