2-{1-[3-(trifluoromethyl)benzene-1-sulfonyl]piperidin-4-yl}-1,3-benzothiazole
Chemical Structure Depiction of
2-{1-[3-(trifluoromethyl)benzene-1-sulfonyl]piperidin-4-yl}-1,3-benzothiazole
2-{1-[3-(trifluoromethyl)benzene-1-sulfonyl]piperidin-4-yl}-1,3-benzothiazole
Compound characteristics
| Compound ID: | D216-0156 |
| Compound Name: | 2-{1-[3-(trifluoromethyl)benzene-1-sulfonyl]piperidin-4-yl}-1,3-benzothiazole |
| Molecular Weight: | 426.48 |
| Molecular Formula: | C19 H17 F3 N2 O2 S2 |
| Smiles: | C1CN(CCC1c1nc2ccccc2s1)S(c1cccc(c1)C(F)(F)F)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.0606 |
| logD: | 5.0606 |
| logSw: | -4.96 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 41.398 |
| InChI Key: | XNBRMAGSHDNXNM-UHFFFAOYSA-N |