ethyl 1-[1-(3,4-dimethylbenzoyl)piperidin-4-yl]-5-(4-ethylphenyl)-1H-pyrazole-3-carboxylate
Chemical Structure Depiction of
ethyl 1-[1-(3,4-dimethylbenzoyl)piperidin-4-yl]-5-(4-ethylphenyl)-1H-pyrazole-3-carboxylate
ethyl 1-[1-(3,4-dimethylbenzoyl)piperidin-4-yl]-5-(4-ethylphenyl)-1H-pyrazole-3-carboxylate
Compound characteristics
| Compound ID: | V001-6994 |
| Compound Name: | ethyl 1-[1-(3,4-dimethylbenzoyl)piperidin-4-yl]-5-(4-ethylphenyl)-1H-pyrazole-3-carboxylate |
| Molecular Weight: | 459.59 |
| Molecular Formula: | C28 H33 N3 O3 |
| Salt: | not_available |
| Smiles: | CCc1ccc(cc1)c1cc(C(=O)OCC)nn1C1CCN(CC1)C(c1ccc(C)c(C)c1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.9689 |
| logD: | 5.9689 |
| logSw: | -5.472 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 50.104 |
| InChI Key: | DJWZOKASQFRCRK-UHFFFAOYSA-N |