2-(2,1,3-benzothiadiazole-4-sulfonyl)-1-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}ethan-1-one
Chemical Structure Depiction of
2-(2,1,3-benzothiadiazole-4-sulfonyl)-1-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}ethan-1-one
2-(2,1,3-benzothiadiazole-4-sulfonyl)-1-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}ethan-1-one
Compound characteristics
| Compound ID: | G845-0079 |
| Compound Name: | 2-(2,1,3-benzothiadiazole-4-sulfonyl)-1-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}ethan-1-one |
| Molecular Weight: | 470.49 |
| Molecular Formula: | C19 H17 F3 N4 O3 S2 |
| Smiles: | C1CN(CCN1C(CS(c1cccc2c1nsn2)(=O)=O)=O)c1cccc(c1)C(F)(F)F |
| Stereo: | ACHIRAL |
| logP: | 3.0297 |
| logD: | 3.0297 |
| logSw: | -3.3276 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 69.609 |
| InChI Key: | AFHXRHPOGDFLEA-UHFFFAOYSA-N |