2-[(6-hydroxy-9H-purin-2-yl)sulfanyl]-1-(piperidin-1-yl)ethan-1-one
Chemical Structure Depiction of
2-[(6-hydroxy-9H-purin-2-yl)sulfanyl]-1-(piperidin-1-yl)ethan-1-one
2-[(6-hydroxy-9H-purin-2-yl)sulfanyl]-1-(piperidin-1-yl)ethan-1-one
Compound characteristics
| Compound ID: | D585-0010 |
| Compound Name: | 2-[(6-hydroxy-9H-purin-2-yl)sulfanyl]-1-(piperidin-1-yl)ethan-1-one |
| Molecular Weight: | 293.34 |
| Molecular Formula: | C12 H15 N5 O2 S |
| Smiles: | C1CCN(CC1)C(CSc1nc(c2c(n1)[nH]cn2)O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.3835 |
| logD: | -0.1559 |
| logSw: | -1.8806 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 73.239 |
| InChI Key: | WQVYFBLQISCIJE-UHFFFAOYSA-N |