5-[(2H-1,3-benzodioxol-5-yl)methylidene]-3-ethyl-2-sulfanylideneimidazolidin-4-one
Chemical Structure Depiction of
5-[(2H-1,3-benzodioxol-5-yl)methylidene]-3-ethyl-2-sulfanylideneimidazolidin-4-one
5-[(2H-1,3-benzodioxol-5-yl)methylidene]-3-ethyl-2-sulfanylideneimidazolidin-4-one
Compound characteristics
| Compound ID: | 5777-0260 |
| Compound Name: | 5-[(2H-1,3-benzodioxol-5-yl)methylidene]-3-ethyl-2-sulfanylideneimidazolidin-4-one |
| Molecular Weight: | 276.31 |
| Molecular Formula: | C13 H12 N2 O3 S |
| Smiles: | CCN1C(/C(=C/c2ccc3c(c2)OCO3)NC1=S)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3358 |
| logD: | 2.3343 |
| logSw: | -3.019 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 44.62 |
| InChI Key: | HYULQNMEHFOIDL-UHFFFAOYSA-N |