{4-[(4-chlorophenyl)sulfanyl]-3,5-dimethyl-1H-pyrazol-1-yl}(phenyl)methanone
Chemical Structure Depiction of
{4-[(4-chlorophenyl)sulfanyl]-3,5-dimethyl-1H-pyrazol-1-yl}(phenyl)methanone
{4-[(4-chlorophenyl)sulfanyl]-3,5-dimethyl-1H-pyrazol-1-yl}(phenyl)methanone
Compound characteristics
| Compound ID: | 3335-0158 |
| Compound Name: | {4-[(4-chlorophenyl)sulfanyl]-3,5-dimethyl-1H-pyrazol-1-yl}(phenyl)methanone |
| Molecular Weight: | 342.85 |
| Molecular Formula: | C18 H15 Cl N2 O S |
| Smiles: | Cc1c(c(C)n(C(c2ccccc2)=O)n1)Sc1ccc(cc1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 4.156 |
| logD: | 4.156 |
| logSw: | -4.6077 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 27.5807 |
| InChI Key: | DFLBDKXABCIISX-UHFFFAOYSA-N |