3-{1-(2-hydroxyethyl)-2-[(3-nitrophenyl)methylidene]hydrazinyl}-1H-1lambda~6~,2-benzothiazole-1,1-dione
Chemical Structure Depiction of
3-{1-(2-hydroxyethyl)-2-[(3-nitrophenyl)methylidene]hydrazinyl}-1H-1lambda~6~,2-benzothiazole-1,1-dione
3-{1-(2-hydroxyethyl)-2-[(3-nitrophenyl)methylidene]hydrazinyl}-1H-1lambda~6~,2-benzothiazole-1,1-dione
Compound characteristics
| Compound ID: | 4994-0425 |
| Compound Name: | 3-{1-(2-hydroxyethyl)-2-[(3-nitrophenyl)methylidene]hydrazinyl}-1H-1lambda~6~,2-benzothiazole-1,1-dione |
| Molecular Weight: | 374.37 |
| Molecular Formula: | C16 H14 N4 O5 S |
| Smiles: | C(CO)N(C1c2ccccc2S(N=1)(=O)=O)/N=C/c1cccc(c1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 1.2682 |
| logD: | 1.2682 |
| logSw: | -2.3579 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 101.21 |
| InChI Key: | GQPOEWFSHWCQKI-UHFFFAOYSA-N |