1-(4-{4-[1-(2,1,3-benzothiadiazole-4-sulfonyl)piperidine-4-carbonyl]piperazin-1-yl}phenyl)ethan-1-one
Chemical Structure Depiction of
1-(4-{4-[1-(2,1,3-benzothiadiazole-4-sulfonyl)piperidine-4-carbonyl]piperazin-1-yl}phenyl)ethan-1-one
1-(4-{4-[1-(2,1,3-benzothiadiazole-4-sulfonyl)piperidine-4-carbonyl]piperazin-1-yl}phenyl)ethan-1-one
Compound characteristics
| Compound ID: | C361-2426 |
| Compound Name: | 1-(4-{4-[1-(2,1,3-benzothiadiazole-4-sulfonyl)piperidine-4-carbonyl]piperazin-1-yl}phenyl)ethan-1-one |
| Molecular Weight: | 513.64 |
| Molecular Formula: | C24 H27 N5 O4 S2 |
| Smiles: | CC(c1ccc(cc1)N1CCN(CC1)C(C1CCN(CC1)S(c1cccc2c1nsn2)(=O)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5665 |
| logD: | 2.5665 |
| logSw: | -2.5943 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 86.637 |
| InChI Key: | UAFSMMZCUCJWCV-UHFFFAOYSA-N |