6-nitro-2-[4-(4-nitrophenyl)piperazin-1-yl]-1,3-benzothiazole
Chemical Structure Depiction of
6-nitro-2-[4-(4-nitrophenyl)piperazin-1-yl]-1,3-benzothiazole
6-nitro-2-[4-(4-nitrophenyl)piperazin-1-yl]-1,3-benzothiazole
Compound characteristics
| Compound ID: | 8008-5504 |
| Compound Name: | 6-nitro-2-[4-(4-nitrophenyl)piperazin-1-yl]-1,3-benzothiazole |
| Molecular Weight: | 385.4 |
| Molecular Formula: | C17 H15 N5 O4 S |
| Smiles: | C1CN(CCN1c1ccc(cc1)[N+]([O-])=O)c1nc2ccc(cc2s1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 4.4083 |
| logD: | 4.4083 |
| logSw: | -4.4023 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 83.25 |
| InChI Key: | MBMDBNBBDYCOIS-UHFFFAOYSA-N |