methyl [(5-bromo-4-hydroxy-6-methylpyrimidin-2-yl)sulfanyl]acetate
Chemical Structure Depiction of
methyl [(5-bromo-4-hydroxy-6-methylpyrimidin-2-yl)sulfanyl]acetate
methyl [(5-bromo-4-hydroxy-6-methylpyrimidin-2-yl)sulfanyl]acetate
Compound characteristics
| Compound ID: | 4386-3945 |
| Compound Name: | methyl [(5-bromo-4-hydroxy-6-methylpyrimidin-2-yl)sulfanyl]acetate |
| Molecular Weight: | 293.14 |
| Molecular Formula: | C8 H9 Br N2 O3 S |
| Smiles: | Cc1c(c(nc(n1)SCC(=O)OC)O)[Br] |
| Stereo: | ACHIRAL |
| logP: | 1.3651 |
| logD: | 0.4328 |
| logSw: | -1.3639 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.648 |
| InChI Key: | VSHIUJBPTYIVEP-UHFFFAOYSA-N |