N-{4-[3,5-bis(trifluoromethyl)-1H-pyrazol-1-yl]phenyl}-2,3-dihydro-1,4-benzodioxine-6-sulfonamide
Chemical Structure Depiction of
N-{4-[3,5-bis(trifluoromethyl)-1H-pyrazol-1-yl]phenyl}-2,3-dihydro-1,4-benzodioxine-6-sulfonamide
N-{4-[3,5-bis(trifluoromethyl)-1H-pyrazol-1-yl]phenyl}-2,3-dihydro-1,4-benzodioxine-6-sulfonamide
Compound characteristics
| Compound ID: | 8016-9212 |
| Compound Name: | N-{4-[3,5-bis(trifluoromethyl)-1H-pyrazol-1-yl]phenyl}-2,3-dihydro-1,4-benzodioxine-6-sulfonamide |
| Molecular Weight: | 493.38 |
| Molecular Formula: | C19 H13 F6 N3 O4 S |
| Smiles: | C1COc2cc(ccc2O1)S(Nc1ccc(cc1)n1c(cc(C(F)(F)F)n1)C(F)(F)F)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5944 |
| logD: | 3.5937 |
| logSw: | -3.8977 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.806 |
| InChI Key: | OAGKDUWFORRGIM-UHFFFAOYSA-N |