N-{5-[(4-nitrophenyl)methylidene]-4-oxo-4,5-dihydro-1,3-thiazol-2-yl}acetamide
Chemical Structure Depiction of
N-{5-[(4-nitrophenyl)methylidene]-4-oxo-4,5-dihydro-1,3-thiazol-2-yl}acetamide
N-{5-[(4-nitrophenyl)methylidene]-4-oxo-4,5-dihydro-1,3-thiazol-2-yl}acetamide
Compound characteristics
| Compound ID: | 8008-9703 |
| Compound Name: | N-{5-[(4-nitrophenyl)methylidene]-4-oxo-4,5-dihydro-1,3-thiazol-2-yl}acetamide |
| Molecular Weight: | 291.28 |
| Molecular Formula: | C12 H9 N3 O4 S |
| Smiles: | CC(NC1=NC(/C(=C\c2ccc(cc2)[N+]([O-])=O)S1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.396 |
| logD: | 1.3392 |
| logSw: | -2.3156 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.355 |
| InChI Key: | QIQKNAUZGZZOBO-UHFFFAOYSA-N |