2-[4-(methylsulfanyl)phenyl]-5-[(thiophen-2-yl)methylidene]-1,3-dioxane-4,6-dione
Chemical Structure Depiction of
2-[4-(methylsulfanyl)phenyl]-5-[(thiophen-2-yl)methylidene]-1,3-dioxane-4,6-dione
2-[4-(methylsulfanyl)phenyl]-5-[(thiophen-2-yl)methylidene]-1,3-dioxane-4,6-dione
Compound characteristics
| Compound ID: | 4940-0557 |
| Compound Name: | 2-[4-(methylsulfanyl)phenyl]-5-[(thiophen-2-yl)methylidene]-1,3-dioxane-4,6-dione |
| Molecular Weight: | 332.39 |
| Molecular Formula: | C16 H12 O4 S2 |
| Smiles: | CSc1ccc(cc1)C1OC(C(=Cc2cccs2)C(=O)O1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5831 |
| logD: | 3.5831 |
| logSw: | -3.6387 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 43.501 |
| InChI Key: | FQYURJNQBOXFJW-UHFFFAOYSA-N |