1-[1-(difluoromethyl)-3,5-dimethyl-1H-pyrazole-4-sulfonyl]-4-{[3-(trifluoromethyl)phenyl]methyl}piperazine
Chemical Structure Depiction of
1-[1-(difluoromethyl)-3,5-dimethyl-1H-pyrazole-4-sulfonyl]-4-{[3-(trifluoromethyl)phenyl]methyl}piperazine
1-[1-(difluoromethyl)-3,5-dimethyl-1H-pyrazole-4-sulfonyl]-4-{[3-(trifluoromethyl)phenyl]methyl}piperazine
Compound characteristics
| Compound ID: | Y502-9456 |
| Compound Name: | 1-[1-(difluoromethyl)-3,5-dimethyl-1H-pyrazole-4-sulfonyl]-4-{[3-(trifluoromethyl)phenyl]methyl}piperazine |
| Molecular Weight: | 452.44 |
| Molecular Formula: | C18 H21 F5 N4 O2 S |
| Smiles: | Cc1c(c(C)n(C(F)F)n1)S(N1CCN(CC1)Cc1cccc(c1)C(F)(F)F)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.9841 |
| logD: | 1.9833 |
| logSw: | -2.4483 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 49.429 |
| InChI Key: | DEDOFRNGUXBNTE-UHFFFAOYSA-N |