4-bromo-N-{5-[(2-nitrophenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}benzamide
Chemical Structure Depiction of
4-bromo-N-{5-[(2-nitrophenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}benzamide
4-bromo-N-{5-[(2-nitrophenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}benzamide
Compound characteristics
| Compound ID: | 2109-0440 |
| Compound Name: | 4-bromo-N-{5-[(2-nitrophenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}benzamide |
| Molecular Weight: | 464.31 |
| Molecular Formula: | C17 H10 Br N3 O4 S2 |
| Smiles: | C(=C1/C(N(C(=S)S1)NC(c1ccc(cc1)[Br])=O)=O)\c1ccccc1[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 3.8645 |
| logD: | 3.683 |
| logSw: | -4.4023 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 75.924 |
| InChI Key: | WKYSKAXMNWWRSA-UHFFFAOYSA-N |