[3,5-dimethyl-4-(phenylsulfanyl)-1H-pyrazol-1-yl](pentafluorophenyl)methanone
Chemical Structure Depiction of
[3,5-dimethyl-4-(phenylsulfanyl)-1H-pyrazol-1-yl](pentafluorophenyl)methanone
[3,5-dimethyl-4-(phenylsulfanyl)-1H-pyrazol-1-yl](pentafluorophenyl)methanone
Compound characteristics
Compound ID: | 3335-0100 |
Compound Name: | [3,5-dimethyl-4-(phenylsulfanyl)-1H-pyrazol-1-yl](pentafluorophenyl)methanone |
Molecular Weight: | 398.35 |
Molecular Formula: | C18 H11 F5 N2 O S |
Smiles: | Cc1c(c(C)n(C(c2c(c(c(c(c2F)F)F)F)F)=O)n1)Sc1ccccc1 |
Stereo: | ACHIRAL |
logP: | 4.34 |
logD: | 4.34 |
logSw: | -4.5029 |
Hydrogen bond acceptors count: | 4 |
Polar surface area: | 27.5807 |
InChI Key: | FIRXGSUUHZTMEJ-UHFFFAOYSA-N |