1-(4-hydroxy-2-sulfanylpyrimidin-5-yl)ethan-1-one
Chemical Structure Depiction of
1-(4-hydroxy-2-sulfanylpyrimidin-5-yl)ethan-1-one
1-(4-hydroxy-2-sulfanylpyrimidin-5-yl)ethan-1-one
Compound characteristics
| Compound ID: | E540-0282 |
| Compound Name: | 1-(4-hydroxy-2-sulfanylpyrimidin-5-yl)ethan-1-one |
| Molecular Weight: | 170.19 |
| Molecular Formula: | C6 H6 N2 O2 S |
| Smiles: | CC(c1cnc(nc1O)S)=O |
| Stereo: | ACHIRAL |
| logP: | -0.0279 |
| logD: | -1.6336 |
| logSw: | -1.3682 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 47.717 |
| InChI Key: | DIJACDRUUFIGOD-UHFFFAOYSA-N |