ethyl 5-tert-butyl-1-[1-(3,4-dichlorobenzoyl)piperidin-4-yl]-1H-pyrazole-3-carboxylate
Chemical Structure Depiction of
ethyl 5-tert-butyl-1-[1-(3,4-dichlorobenzoyl)piperidin-4-yl]-1H-pyrazole-3-carboxylate
ethyl 5-tert-butyl-1-[1-(3,4-dichlorobenzoyl)piperidin-4-yl]-1H-pyrazole-3-carboxylate
Compound characteristics
| Compound ID: | V001-7041 |
| Compound Name: | ethyl 5-tert-butyl-1-[1-(3,4-dichlorobenzoyl)piperidin-4-yl]-1H-pyrazole-3-carboxylate |
| Molecular Weight: | 452.38 |
| Molecular Formula: | C22 H27 Cl2 N3 O3 |
| Salt: | not_available |
| Smiles: | CCOC(c1cc(C(C)(C)C)n(C2CCN(CC2)C(c2ccc(c(c2)[Cl])[Cl])=O)n1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.9327 |
| logD: | 4.9327 |
| logSw: | -5.1043 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 50.376 |
| InChI Key: | SVBFMEWJZSGBDG-UHFFFAOYSA-N |