2-{[2-(3,4-dihydroxyphenyl)-2-oxoethyl]sulfanyl}-4-(furan-2-yl)-6-methylpyridine-3-carbonitrile
Chemical Structure Depiction of
2-{[2-(3,4-dihydroxyphenyl)-2-oxoethyl]sulfanyl}-4-(furan-2-yl)-6-methylpyridine-3-carbonitrile
2-{[2-(3,4-dihydroxyphenyl)-2-oxoethyl]sulfanyl}-4-(furan-2-yl)-6-methylpyridine-3-carbonitrile
Compound characteristics
| Compound ID: | 8011-4698 |
| Compound Name: | 2-{[2-(3,4-dihydroxyphenyl)-2-oxoethyl]sulfanyl}-4-(furan-2-yl)-6-methylpyridine-3-carbonitrile |
| Molecular Weight: | 366.39 |
| Molecular Formula: | C19 H14 N2 O4 S |
| Smiles: | Cc1cc(c(C#N)c(n1)SCC(c1ccc(c(c1)O)O)=O)c1ccco1 |
| Stereo: | ACHIRAL |
| logP: | 3.0966 |
| logD: | 2.9142 |
| logSw: | -3.1312 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 80.227 |
| InChI Key: | KWDOKIPEOQXMIR-UHFFFAOYSA-N |