3-methyl-4-[(pentafluorophenyl)sulfanyl]-1-phenyl-1H-pyrazol-5-yl methoxyacetate
Chemical Structure Depiction of
3-methyl-4-[(pentafluorophenyl)sulfanyl]-1-phenyl-1H-pyrazol-5-yl methoxyacetate
3-methyl-4-[(pentafluorophenyl)sulfanyl]-1-phenyl-1H-pyrazol-5-yl methoxyacetate
Compound characteristics
| Compound ID: | C100-0379 |
| Compound Name: | 3-methyl-4-[(pentafluorophenyl)sulfanyl]-1-phenyl-1H-pyrazol-5-yl methoxyacetate |
| Molecular Weight: | 444.38 |
| Molecular Formula: | C19 H13 F5 N2 O3 S |
| Smiles: | Cc1c(c(n(c2ccccc2)n1)OC(COC)=O)Sc1c(c(c(c(c1F)F)F)F)F |
| Stereo: | ACHIRAL |
| logP: | 3.8339 |
| logD: | 3.8339 |
| logSw: | -4.094 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 42.379 |
| InChI Key: | QLTVXBKRRUTEJG-UHFFFAOYSA-N |