3-{2-[(2-hydroxy-3-methoxy-5-nitrophenyl)methylidene]-1-methylhydrazinyl}-6-nitro-1H-1lambda~6~,2-benzothiazole-1,1-dione
Chemical Structure Depiction of
3-{2-[(2-hydroxy-3-methoxy-5-nitrophenyl)methylidene]-1-methylhydrazinyl}-6-nitro-1H-1lambda~6~,2-benzothiazole-1,1-dione
3-{2-[(2-hydroxy-3-methoxy-5-nitrophenyl)methylidene]-1-methylhydrazinyl}-6-nitro-1H-1lambda~6~,2-benzothiazole-1,1-dione
Compound characteristics
| Compound ID: | 8005-9561 |
| Compound Name: | 3-{2-[(2-hydroxy-3-methoxy-5-nitrophenyl)methylidene]-1-methylhydrazinyl}-6-nitro-1H-1lambda~6~,2-benzothiazole-1,1-dione |
| Molecular Weight: | 435.37 |
| Molecular Formula: | C16 H13 N5 O8 S |
| Smiles: | CN(C1c2ccc(cc2S(N=1)(=O)=O)[N+]([O-])=O)/N=C/c1cc(cc(c1O)OC)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 1.844 |
| logD: | 1.1779 |
| logSw: | -2.5502 |
| Hydrogen bond acceptors count: | 16 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 141.298 |
| InChI Key: | YLTITADVZXTJAB-UHFFFAOYSA-N |