ethyl 5-[4-(4-butanoylpiperazin-1-yl)phenyl]-1-(2-chlorophenyl)-1H-pyrazole-3-carboxylate
Chemical Structure Depiction of
ethyl 5-[4-(4-butanoylpiperazin-1-yl)phenyl]-1-(2-chlorophenyl)-1H-pyrazole-3-carboxylate
ethyl 5-[4-(4-butanoylpiperazin-1-yl)phenyl]-1-(2-chlorophenyl)-1H-pyrazole-3-carboxylate
Compound characteristics
| Compound ID: | V008-2735 |
| Compound Name: | ethyl 5-[4-(4-butanoylpiperazin-1-yl)phenyl]-1-(2-chlorophenyl)-1H-pyrazole-3-carboxylate |
| Molecular Weight: | 480.99 |
| Molecular Formula: | C26 H29 Cl N4 O3 |
| Salt: | not_available |
| Smiles: | CCCC(N1CCN(CC1)c1ccc(cc1)c1cc(C(=O)OCC)nn1c1ccccc1[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 5.1431 |
| logD: | 5.1431 |
| logSw: | -5.7277 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 53.167 |
| InChI Key: | JMICWONVDYAAKC-UHFFFAOYSA-N |