3-(diethylamino)-6-nitro-1H-1lambda~6~,2-benzothiazole-1,1-dione
Chemical Structure Depiction of
3-(diethylamino)-6-nitro-1H-1lambda~6~,2-benzothiazole-1,1-dione
3-(diethylamino)-6-nitro-1H-1lambda~6~,2-benzothiazole-1,1-dione
Compound characteristics
| Compound ID: | 8005-1578 |
| Compound Name: | 3-(diethylamino)-6-nitro-1H-1lambda~6~,2-benzothiazole-1,1-dione |
| Molecular Weight: | 283.3 |
| Molecular Formula: | C11 H13 N3 O4 S |
| Smiles: | CCN(CC)C1c2ccc(cc2S(N=1)(=O)=O)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 1.8522 |
| logD: | 1.8522 |
| logSw: | -2.6673 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 75.796 |
| InChI Key: | YPTHWVGBJQUCBJ-UHFFFAOYSA-N |