2-{5-[(3-bromophenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}-N-tert-butyl-N-(2-hydroxyethyl)acetamide
Chemical Structure Depiction of
2-{5-[(3-bromophenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}-N-tert-butyl-N-(2-hydroxyethyl)acetamide
2-{5-[(3-bromophenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}-N-tert-butyl-N-(2-hydroxyethyl)acetamide
Compound characteristics
| Compound ID: | 3453-0173 |
| Compound Name: | 2-{5-[(3-bromophenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}-N-tert-butyl-N-(2-hydroxyethyl)acetamide |
| Molecular Weight: | 457.41 |
| Molecular Formula: | C18 H21 Br N2 O3 S2 |
| Smiles: | CC(C)(C)N(CCO)C(CN1C(/C(=C/c2cccc(c2)[Br])SC1=S)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0235 |
| logD: | 3.0235 |
| logSw: | -3.0177 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.41 |
| InChI Key: | KZLXJWHKKKGGPY-UHFFFAOYSA-N |