1-[1-(4-fluorobenzene-1-sulfonyl)-3,5-dimethyl-1H-pyrazol-4-yl]ethan-1-one
Chemical Structure Depiction of
1-[1-(4-fluorobenzene-1-sulfonyl)-3,5-dimethyl-1H-pyrazol-4-yl]ethan-1-one
1-[1-(4-fluorobenzene-1-sulfonyl)-3,5-dimethyl-1H-pyrazol-4-yl]ethan-1-one
Compound characteristics
| Compound ID: | 8018-1296 |
| Compound Name: | 1-[1-(4-fluorobenzene-1-sulfonyl)-3,5-dimethyl-1H-pyrazol-4-yl]ethan-1-one |
| Molecular Weight: | 296.32 |
| Molecular Formula: | C13 H13 F N2 O3 S |
| Smiles: | CC(c1c(C)nn(c1C)S(c1ccc(cc1)F)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.4133 |
| logD: | 1.4133 |
| logSw: | -2.4246 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 54.686 |
| InChI Key: | DHUIDBAMQIWGFO-UHFFFAOYSA-N |