3-propyl-6-{4-[2-(trifluoromethyl)benzoyl]piperazine-1-sulfonyl}-1,3-benzothiazol-2(3H)-one
Chemical Structure Depiction of
3-propyl-6-{4-[2-(trifluoromethyl)benzoyl]piperazine-1-sulfonyl}-1,3-benzothiazol-2(3H)-one
3-propyl-6-{4-[2-(trifluoromethyl)benzoyl]piperazine-1-sulfonyl}-1,3-benzothiazol-2(3H)-one
Compound characteristics
| Compound ID: | L475-0748 |
| Compound Name: | 3-propyl-6-{4-[2-(trifluoromethyl)benzoyl]piperazine-1-sulfonyl}-1,3-benzothiazol-2(3H)-one |
| Molecular Weight: | 513.56 |
| Molecular Formula: | C22 H22 F3 N3 O4 S2 |
| Smiles: | CCCN1C(=O)Sc2cc(ccc12)S(N1CCN(CC1)C(c1ccccc1C(F)(F)F)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0659 |
| logD: | 4.0659 |
| logSw: | -4.1231 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 64.228 |
| InChI Key: | QUVPRBNTAAGOMB-UHFFFAOYSA-N |