N-(2,1,3-benzothiadiazol-4-yl)-2-(4-{[3-(trifluoromethyl)phenyl]methyl}piperazin-1-yl)acetamide
Chemical Structure Depiction of
N-(2,1,3-benzothiadiazol-4-yl)-2-(4-{[3-(trifluoromethyl)phenyl]methyl}piperazin-1-yl)acetamide
N-(2,1,3-benzothiadiazol-4-yl)-2-(4-{[3-(trifluoromethyl)phenyl]methyl}piperazin-1-yl)acetamide
Compound characteristics
| Compound ID: | Y206-6813 |
| Compound Name: | N-(2,1,3-benzothiadiazol-4-yl)-2-(4-{[3-(trifluoromethyl)phenyl]methyl}piperazin-1-yl)acetamide |
| Molecular Weight: | 435.47 |
| Molecular Formula: | C20 H20 F3 N5 O S |
| Smiles: | C1CN(CCN1CC(Nc1cccc2c1nsn2)=O)Cc1cccc(c1)C(F)(F)F |
| Stereo: | ACHIRAL |
| logP: | 3.7928 |
| logD: | 3.7739 |
| logSw: | -4.0815 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.916 |
| InChI Key: | SQUNFWFKGBFLMD-UHFFFAOYSA-N |