2-[(6-ethoxy-1,3-benzothiazol-2-yl)sulfanyl]-1-[4-(6-nitro-1,3-benzothiazol-2-yl)piperazin-1-yl]propan-1-one
Chemical Structure Depiction of
2-[(6-ethoxy-1,3-benzothiazol-2-yl)sulfanyl]-1-[4-(6-nitro-1,3-benzothiazol-2-yl)piperazin-1-yl]propan-1-one
2-[(6-ethoxy-1,3-benzothiazol-2-yl)sulfanyl]-1-[4-(6-nitro-1,3-benzothiazol-2-yl)piperazin-1-yl]propan-1-one
Compound characteristics
| Compound ID: | 8010-3656 |
| Compound Name: | 2-[(6-ethoxy-1,3-benzothiazol-2-yl)sulfanyl]-1-[4-(6-nitro-1,3-benzothiazol-2-yl)piperazin-1-yl]propan-1-one |
| Molecular Weight: | 529.66 |
| Molecular Formula: | C23 H23 N5 O4 S3 |
| Smiles: | CCOc1ccc2c(c1)sc(n2)SC(C)C(N1CCN(CC1)c1nc2ccc(cc2s1)[N+]([O-])=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.8941 |
| logD: | 5.894 |
| logSw: | -5.4296 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 79.269 |
| InChI Key: | UVVFFWQCSUZHCN-AWEZNQCLSA-N |