ethyl 4-benzoyl-1-(3-methylphenyl)-1H-pyrazole-3-carboxylate
Chemical Structure Depiction of
ethyl 4-benzoyl-1-(3-methylphenyl)-1H-pyrazole-3-carboxylate
ethyl 4-benzoyl-1-(3-methylphenyl)-1H-pyrazole-3-carboxylate
Compound characteristics
| Compound ID: | 8012-9808 |
| Compound Name: | ethyl 4-benzoyl-1-(3-methylphenyl)-1H-pyrazole-3-carboxylate |
| Molecular Weight: | 334.37 |
| Molecular Formula: | C20 H18 N2 O3 |
| Smiles: | CCOC(c1c(cn(c2cccc(C)c2)n1)C(c1ccccc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9811 |
| logD: | 3.9811 |
| logSw: | -4.0159 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 49.363 |
| InChI Key: | XXDGWQUNCARASG-UHFFFAOYSA-N |