5-[(6-bromo-2H-1,3-benzodioxol-5-yl)methylidene]-3-ethyl-2-sulfanylideneimidazolidin-4-one
Chemical Structure Depiction of
5-[(6-bromo-2H-1,3-benzodioxol-5-yl)methylidene]-3-ethyl-2-sulfanylideneimidazolidin-4-one
5-[(6-bromo-2H-1,3-benzodioxol-5-yl)methylidene]-3-ethyl-2-sulfanylideneimidazolidin-4-one
Compound characteristics
| Compound ID: | 5777-0263 |
| Compound Name: | 5-[(6-bromo-2H-1,3-benzodioxol-5-yl)methylidene]-3-ethyl-2-sulfanylideneimidazolidin-4-one |
| Molecular Weight: | 355.21 |
| Molecular Formula: | C13 H11 Br N2 O3 S |
| Smiles: | CCN1C(/C(=C/c2cc3c(cc2[Br])OCO3)NC1=S)=O |
| Stereo: | ACHIRAL |
| logP: | 2.828 |
| logD: | 2.8164 |
| logSw: | -3.2406 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 44.62 |
| InChI Key: | YTBREEGVCOYNPX-UHFFFAOYSA-N |