4-[2-methyl-4-(4-nitrophenyl)piperazine-1-sulfonyl]-2,1,3-benzothiadiazole
Chemical Structure Depiction of
4-[2-methyl-4-(4-nitrophenyl)piperazine-1-sulfonyl]-2,1,3-benzothiadiazole
4-[2-methyl-4-(4-nitrophenyl)piperazine-1-sulfonyl]-2,1,3-benzothiadiazole
Compound characteristics
| Compound ID: | K666-0040 |
| Compound Name: | 4-[2-methyl-4-(4-nitrophenyl)piperazine-1-sulfonyl]-2,1,3-benzothiadiazole |
| Molecular Weight: | 419.48 |
| Molecular Formula: | C17 H17 N5 O4 S2 |
| Smiles: | CC1CN(CCN1S(c1cccc2c1nsn2)(=O)=O)c1ccc(cc1)[N+]([O-])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.3183 |
| logD: | 3.3183 |
| logSw: | -3.6532 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 89.539 |
| InChI Key: | XEGRFBZPMZEXLF-LBPRGKRZSA-N |