2-(4-chlorophenoxy)-1-{4-[(4-chlorophenyl)sulfanyl]-3,5-dimethyl-1H-pyrazol-1-yl}ethan-1-one
Chemical Structure Depiction of
2-(4-chlorophenoxy)-1-{4-[(4-chlorophenyl)sulfanyl]-3,5-dimethyl-1H-pyrazol-1-yl}ethan-1-one
2-(4-chlorophenoxy)-1-{4-[(4-chlorophenyl)sulfanyl]-3,5-dimethyl-1H-pyrazol-1-yl}ethan-1-one
Compound characteristics
| Compound ID: | 3335-0171 |
| Compound Name: | 2-(4-chlorophenoxy)-1-{4-[(4-chlorophenyl)sulfanyl]-3,5-dimethyl-1H-pyrazol-1-yl}ethan-1-one |
| Molecular Weight: | 407.32 |
| Molecular Formula: | C19 H16 Cl2 N2 O2 S |
| Smiles: | Cc1c(c(C)n(C(COc2ccc(cc2)[Cl])=O)n1)Sc1ccc(cc1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 4.5873 |
| logD: | 4.5873 |
| logSw: | -4.7236 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 34.552 |
| InChI Key: | ZHHRVEWDQUMMEY-UHFFFAOYSA-N |