1-(3,5-dimethyl-1-phenyl-1H-pyrazol-4-yl)ethan-1-one
Chemical Structure Depiction of
1-(3,5-dimethyl-1-phenyl-1H-pyrazol-4-yl)ethan-1-one
1-(3,5-dimethyl-1-phenyl-1H-pyrazol-4-yl)ethan-1-one
Compound characteristics
| Compound ID: | 6623-0791 |
| Compound Name: | 1-(3,5-dimethyl-1-phenyl-1H-pyrazol-4-yl)ethan-1-one |
| Molecular Weight: | 214.26 |
| Molecular Formula: | C13 H14 N2 O |
| Smiles: | CC(c1c(C)nn(c2ccccc2)c1C)=O |
| Stereo: | ACHIRAL |
| logP: | 1.8085 |
| logD: | 1.8085 |
| logSw: | -1.9164 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 28.4831 |
| InChI Key: | BYBPRELHKWHPLX-UHFFFAOYSA-N |