5-[(3-ethoxy-4-hydroxyphenyl)methylidene]-3-(4-nitrophenyl)-2-sulfanylidene-1,3-thiazolidin-4-one
Chemical Structure Depiction of
5-[(3-ethoxy-4-hydroxyphenyl)methylidene]-3-(4-nitrophenyl)-2-sulfanylidene-1,3-thiazolidin-4-one
5-[(3-ethoxy-4-hydroxyphenyl)methylidene]-3-(4-nitrophenyl)-2-sulfanylidene-1,3-thiazolidin-4-one
Compound characteristics
| Compound ID: | 3649-0064 |
| Compound Name: | 5-[(3-ethoxy-4-hydroxyphenyl)methylidene]-3-(4-nitrophenyl)-2-sulfanylidene-1,3-thiazolidin-4-one |
| Molecular Weight: | 402.45 |
| Molecular Formula: | C18 H14 N2 O5 S2 |
| Smiles: | CCOc1cc(\C=C2/C(N(C(=S)S2)c2ccc(cc2)[N+]([O-])=O)=O)ccc1O |
| Stereo: | ACHIRAL |
| logP: | 3.572 |
| logD: | 3.5695 |
| logSw: | -3.5175 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.971 |
| InChI Key: | JPKXMRHQMUZCOT-UHFFFAOYSA-N |