1-(4-{4-[4-(5-chloro-2-methylphenyl)piperazine-1-carbonyl]-1-(3,4-dimethylphenyl)-1H-pyrazol-5-yl}piperidin-1-yl)ethan-1-one
Chemical Structure Depiction of
1-(4-{4-[4-(5-chloro-2-methylphenyl)piperazine-1-carbonyl]-1-(3,4-dimethylphenyl)-1H-pyrazol-5-yl}piperidin-1-yl)ethan-1-one
1-(4-{4-[4-(5-chloro-2-methylphenyl)piperazine-1-carbonyl]-1-(3,4-dimethylphenyl)-1H-pyrazol-5-yl}piperidin-1-yl)ethan-1-one
Compound characteristics
| Compound ID: | C561-3233 |
| Compound Name: | 1-(4-{4-[4-(5-chloro-2-methylphenyl)piperazine-1-carbonyl]-1-(3,4-dimethylphenyl)-1H-pyrazol-5-yl}piperidin-1-yl)ethan-1-one |
| Molecular Weight: | 534.1 |
| Molecular Formula: | C30 H36 Cl N5 O2 |
| Smiles: | CC(N1CCC(CC1)c1c(cnn1c1ccc(C)c(C)c1)C(N1CCN(CC1)c1cc(ccc1C)[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.2248 |
| logD: | 6.2248 |
| logSw: | -6.1009 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 50.057 |
| InChI Key: | XRVOFMHHQNKIMV-UHFFFAOYSA-N |