4-[4-(methylsulfanyl)phenyl]-3,4-dihydro-2H,5H-pyrano[3,2-c][1]benzopyran-2,5-dione
Chemical Structure Depiction of
4-[4-(methylsulfanyl)phenyl]-3,4-dihydro-2H,5H-pyrano[3,2-c][1]benzopyran-2,5-dione
4-[4-(methylsulfanyl)phenyl]-3,4-dihydro-2H,5H-pyrano[3,2-c][1]benzopyran-2,5-dione
Compound characteristics
| Compound ID: | 8016-4492 |
| Compound Name: | 4-[4-(methylsulfanyl)phenyl]-3,4-dihydro-2H,5H-pyrano[3,2-c][1]benzopyran-2,5-dione |
| Molecular Weight: | 338.38 |
| Molecular Formula: | C19 H14 O4 S |
| Smiles: | CSc1ccc(cc1)C1CC(=O)OC2=C1C(=O)Oc1ccccc12 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.5131 |
| logD: | 3.5131 |
| logSw: | -3.9049 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 41.78 |
| InChI Key: | OMWPXFKQYJBFAR-AWEZNQCLSA-N |