3-(3,5-dimethyl-1H-pyrazol-1-yl)-N-{2-[4-(methylsulfanyl)phenyl]ethyl}butanamide
Chemical Structure Depiction of
3-(3,5-dimethyl-1H-pyrazol-1-yl)-N-{2-[4-(methylsulfanyl)phenyl]ethyl}butanamide
3-(3,5-dimethyl-1H-pyrazol-1-yl)-N-{2-[4-(methylsulfanyl)phenyl]ethyl}butanamide
Compound characteristics
| Compound ID: | G262-0718 |
| Compound Name: | 3-(3,5-dimethyl-1H-pyrazol-1-yl)-N-{2-[4-(methylsulfanyl)phenyl]ethyl}butanamide |
| Molecular Weight: | 331.48 |
| Molecular Formula: | C18 H25 N3 O S |
| Smiles: | CC(CC(NCCc1ccc(cc1)SC)=O)n1c(C)cc(C)n1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.139 |
| logD: | 2.1389 |
| logSw: | -2.8037 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 38.34 |
| InChI Key: | XLIPZZGVAYDSIA-HNNXBMFYSA-N |