ethyl 3-{[(pyridin-2-yl)sulfanyl]methyl}-1-benzofuran-2-carboxylate
Chemical Structure Depiction of
ethyl 3-{[(pyridin-2-yl)sulfanyl]methyl}-1-benzofuran-2-carboxylate
ethyl 3-{[(pyridin-2-yl)sulfanyl]methyl}-1-benzofuran-2-carboxylate
Compound characteristics
| Compound ID: | 6526-0223 |
| Compound Name: | ethyl 3-{[(pyridin-2-yl)sulfanyl]methyl}-1-benzofuran-2-carboxylate |
| Molecular Weight: | 313.37 |
| Molecular Formula: | C17 H15 N O3 S |
| Smiles: | CCOC(c1c(CSc2ccccn2)c2ccccc2o1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3156 |
| logD: | 4.3155 |
| logSw: | -4.2179 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 37.655 |
| InChI Key: | VATDWNVUQUQJHU-UHFFFAOYSA-N |