3-{4-[3-fluoro-5-(trifluoromethyl)benzoyl]piperazin-1-yl}-4-methoxy-N-(2-methoxyethyl)benzene-1-sulfonamide
Chemical Structure Depiction of
3-{4-[3-fluoro-5-(trifluoromethyl)benzoyl]piperazin-1-yl}-4-methoxy-N-(2-methoxyethyl)benzene-1-sulfonamide
3-{4-[3-fluoro-5-(trifluoromethyl)benzoyl]piperazin-1-yl}-4-methoxy-N-(2-methoxyethyl)benzene-1-sulfonamide
Compound characteristics
| Compound ID: | V011-1131 |
| Compound Name: | 3-{4-[3-fluoro-5-(trifluoromethyl)benzoyl]piperazin-1-yl}-4-methoxy-N-(2-methoxyethyl)benzene-1-sulfonamide |
| Molecular Weight: | 519.51 |
| Molecular Formula: | C22 H25 F4 N3 O5 S |
| Salt: | not_available |
| Smiles: | COCCNS(c1ccc(c(c1)N1CCN(CC1)C(c1cc(cc(c1)F)C(F)(F)F)=O)OC)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3298 |
| logD: | 3.3297 |
| logSw: | -3.8646 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.69 |
| InChI Key: | CRHKAROOLYBOHN-UHFFFAOYSA-N |