6,7-dimethoxy-4-{[4-(methylsulfanyl)phenyl]methylidene}-1,4-dihydro-3H-2-benzopyran-3-one
Chemical Structure Depiction of
6,7-dimethoxy-4-{[4-(methylsulfanyl)phenyl]methylidene}-1,4-dihydro-3H-2-benzopyran-3-one
6,7-dimethoxy-4-{[4-(methylsulfanyl)phenyl]methylidene}-1,4-dihydro-3H-2-benzopyran-3-one
Compound characteristics
| Compound ID: | Y041-3669 |
| Compound Name: | 6,7-dimethoxy-4-{[4-(methylsulfanyl)phenyl]methylidene}-1,4-dihydro-3H-2-benzopyran-3-one |
| Molecular Weight: | 342.41 |
| Molecular Formula: | C19 H18 O4 S |
| Smiles: | COc1cc2COC(C(=C/c3ccc(cc3)SC)\c2cc1OC)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1168 |
| logD: | 4.1168 |
| logSw: | -4.412 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 37.434 |
| InChI Key: | HRDMOQYPWZFQBW-UHFFFAOYSA-N |