1-[1-(difluoromethyl)-3-methyl-1H-pyrazole-4-sulfonyl]-4-{[3-(trifluoromethyl)phenyl]methyl}piperazine
Chemical Structure Depiction of
1-[1-(difluoromethyl)-3-methyl-1H-pyrazole-4-sulfonyl]-4-{[3-(trifluoromethyl)phenyl]methyl}piperazine
1-[1-(difluoromethyl)-3-methyl-1H-pyrazole-4-sulfonyl]-4-{[3-(trifluoromethyl)phenyl]methyl}piperazine
Compound characteristics
| Compound ID: | Y501-4844 |
| Compound Name: | 1-[1-(difluoromethyl)-3-methyl-1H-pyrazole-4-sulfonyl]-4-{[3-(trifluoromethyl)phenyl]methyl}piperazine |
| Molecular Weight: | 438.42 |
| Molecular Formula: | C17 H19 F5 N4 O2 S |
| Smiles: | Cc1c(cn(C(F)F)n1)S(N1CCN(CC1)Cc1cccc(c1)C(F)(F)F)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.9366 |
| logD: | 1.9358 |
| logSw: | -2.3174 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 49.722 |
| InChI Key: | OFSQDXQXWHMXLK-UHFFFAOYSA-N |