5-[(2H-1,3-benzodioxol-5-yl)methylidene]-3-ethyl-2-(ethylimino)-1,3-thiazolidin-4-one
Chemical Structure Depiction of
5-[(2H-1,3-benzodioxol-5-yl)methylidene]-3-ethyl-2-(ethylimino)-1,3-thiazolidin-4-one
5-[(2H-1,3-benzodioxol-5-yl)methylidene]-3-ethyl-2-(ethylimino)-1,3-thiazolidin-4-one
Compound characteristics
| Compound ID: | 8013-0528 |
| Compound Name: | 5-[(2H-1,3-benzodioxol-5-yl)methylidene]-3-ethyl-2-(ethylimino)-1,3-thiazolidin-4-one |
| Molecular Weight: | 304.37 |
| Molecular Formula: | C15 H16 N2 O3 S |
| Smiles: | CC/N=C1\N(CC)C(/C(=C\c2ccc3c(c2)OCO3)S1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2151 |
| logD: | 3.2151 |
| logSw: | -3.3098 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 42.392 |
| InChI Key: | PQKGCBWYWSVVFC-UHFFFAOYSA-N |