[3,5-dimethyl-4-(phenylsulfanyl)-1H-pyrazol-1-yl](3,4,5-trimethoxyphenyl)methanone
Chemical Structure Depiction of
[3,5-dimethyl-4-(phenylsulfanyl)-1H-pyrazol-1-yl](3,4,5-trimethoxyphenyl)methanone
[3,5-dimethyl-4-(phenylsulfanyl)-1H-pyrazol-1-yl](3,4,5-trimethoxyphenyl)methanone
Compound characteristics
| Compound ID: | 3335-0241 |
| Compound Name: | [3,5-dimethyl-4-(phenylsulfanyl)-1H-pyrazol-1-yl](3,4,5-trimethoxyphenyl)methanone |
| Molecular Weight: | 398.48 |
| Molecular Formula: | C21 H22 N2 O4 S |
| Smiles: | Cc1c(c(C)n(C(c2cc(c(c(c2)OC)OC)OC)=O)n1)Sc1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 3.1964 |
| logD: | 3.1964 |
| logSw: | -3.3871 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 50.559 |
| InChI Key: | CQEQIRQYAGEPQK-UHFFFAOYSA-N |