3-methyl-6-{4-[3-(trifluoromethyl)phenyl]piperazine-1-sulfonyl}-1,3-benzothiazol-2(3H)-one
Chemical Structure Depiction of
3-methyl-6-{4-[3-(trifluoromethyl)phenyl]piperazine-1-sulfonyl}-1,3-benzothiazol-2(3H)-one
3-methyl-6-{4-[3-(trifluoromethyl)phenyl]piperazine-1-sulfonyl}-1,3-benzothiazol-2(3H)-one
Compound characteristics
| Compound ID: | F818-0522 |
| Compound Name: | 3-methyl-6-{4-[3-(trifluoromethyl)phenyl]piperazine-1-sulfonyl}-1,3-benzothiazol-2(3H)-one |
| Molecular Weight: | 457.49 |
| Molecular Formula: | C19 H18 F3 N3 O3 S2 |
| Smiles: | CN1C(=O)Sc2cc(ccc12)S(N1CCN(CC1)c1cccc(c1)C(F)(F)F)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1968 |
| logD: | 4.1968 |
| logSw: | -4.3147 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 50.82 |
| InChI Key: | YIASWWVGUMPIHA-UHFFFAOYSA-N |