ethyl 4-{5-[(6-bromo-2H-1,3-benzodioxol-5-yl)methylidene]-2-imino-4-oxo-1,3-thiazolidin-3-yl}benzoate
Chemical Structure Depiction of
ethyl 4-{5-[(6-bromo-2H-1,3-benzodioxol-5-yl)methylidene]-2-imino-4-oxo-1,3-thiazolidin-3-yl}benzoate
ethyl 4-{5-[(6-bromo-2H-1,3-benzodioxol-5-yl)methylidene]-2-imino-4-oxo-1,3-thiazolidin-3-yl}benzoate
Compound characteristics
| Compound ID: | 8012-5445 |
| Compound Name: | ethyl 4-{5-[(6-bromo-2H-1,3-benzodioxol-5-yl)methylidene]-2-imino-4-oxo-1,3-thiazolidin-3-yl}benzoate |
| Molecular Weight: | 475.32 |
| Molecular Formula: | C20 H15 Br N2 O5 S |
| Smiles: | CCOC(c1ccc(cc1)N1C(=N)SC(=C/c2cc3c(cc2[Br])OCO3)\C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3295 |
| logD: | 4.3295 |
| logSw: | -4.2774 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.238 |
| InChI Key: | JDHQIZULYLBAOG-UHFFFAOYSA-N |