{4-[3,5-dimethyl-1-(propan-2-yl)-1H-pyrazole-4-sulfonyl]piperazin-1-yl}[3-(trifluoromethyl)phenyl]methanone
Chemical Structure Depiction of
{4-[3,5-dimethyl-1-(propan-2-yl)-1H-pyrazole-4-sulfonyl]piperazin-1-yl}[3-(trifluoromethyl)phenyl]methanone
{4-[3,5-dimethyl-1-(propan-2-yl)-1H-pyrazole-4-sulfonyl]piperazin-1-yl}[3-(trifluoromethyl)phenyl]methanone
Compound characteristics
| Compound ID: | F897-1028 |
| Compound Name: | {4-[3,5-dimethyl-1-(propan-2-yl)-1H-pyrazole-4-sulfonyl]piperazin-1-yl}[3-(trifluoromethyl)phenyl]methanone |
| Molecular Weight: | 458.5 |
| Molecular Formula: | C20 H25 F3 N4 O3 S |
| Smiles: | CC(C)n1c(C)c(c(C)n1)S(N1CCN(CC1)C(c1cccc(c1)C(F)(F)F)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.1261 |
| logD: | 2.1261 |
| logSw: | -2.6837 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 63.427 |
| InChI Key: | KDOWMTDNZDRVNY-UHFFFAOYSA-N |