2-(3,4-dimethoxyphenyl)-1-{4-[3-(2,4-dimethylphenyl)-1H-pyrazole-5-carbonyl]piperazin-1-yl}ethan-1-one
Chemical Structure Depiction of
2-(3,4-dimethoxyphenyl)-1-{4-[3-(2,4-dimethylphenyl)-1H-pyrazole-5-carbonyl]piperazin-1-yl}ethan-1-one
2-(3,4-dimethoxyphenyl)-1-{4-[3-(2,4-dimethylphenyl)-1H-pyrazole-5-carbonyl]piperazin-1-yl}ethan-1-one
Compound characteristics
| Compound ID: | E687-0440 |
| Compound Name: | 2-(3,4-dimethoxyphenyl)-1-{4-[3-(2,4-dimethylphenyl)-1H-pyrazole-5-carbonyl]piperazin-1-yl}ethan-1-one |
| Molecular Weight: | 462.55 |
| Molecular Formula: | C26 H30 N4 O4 |
| Smiles: | Cc1ccc(c(C)c1)c1cc(C(N2CCN(CC2)C(Cc2ccc(c(c2)OC)OC)=O)=O)[nH]n1 |
| Stereo: | ACHIRAL |
| logP: | 3.4599 |
| logD: | 3.4596 |
| logSw: | -3.4998 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.566 |
| InChI Key: | CCRIFJRKHBGIMP-UHFFFAOYSA-N |