[1-(2,1,3-benzothiadiazole-4-sulfonyl)piperidin-4-yl]{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}methanone
Chemical Structure Depiction of
[1-(2,1,3-benzothiadiazole-4-sulfonyl)piperidin-4-yl]{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}methanone
[1-(2,1,3-benzothiadiazole-4-sulfonyl)piperidin-4-yl]{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}methanone
Compound characteristics
Compound ID: | C361-2436 |
Compound Name: | [1-(2,1,3-benzothiadiazole-4-sulfonyl)piperidin-4-yl]{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}methanone |
Molecular Weight: | 539.6 |
Molecular Formula: | C23 H24 F3 N5 O3 S2 |
Smiles: | C1CN(CCC1C(N1CCN(CC1)c1cccc(c1)C(F)(F)F)=O)S(c1cccc2c1nsn2)(=O)=O |
Stereo: | ACHIRAL |
logP: | 3.7036 |
logD: | 3.7036 |
logSw: | -4.1257 |
Hydrogen bond acceptors count: | 9 |
Polar surface area: | 72.811 |
InChI Key: | RYQQSPCEXPJZDL-UHFFFAOYSA-N |