{4-[3-(2,4-dimethylphenyl)-1H-pyrazole-5-carbonyl]piperazin-1-yl}(3,4,5-trimethoxyphenyl)methanone
Chemical Structure Depiction of
{4-[3-(2,4-dimethylphenyl)-1H-pyrazole-5-carbonyl]piperazin-1-yl}(3,4,5-trimethoxyphenyl)methanone
{4-[3-(2,4-dimethylphenyl)-1H-pyrazole-5-carbonyl]piperazin-1-yl}(3,4,5-trimethoxyphenyl)methanone
Compound characteristics
| Compound ID: | E687-0590 |
| Compound Name: | {4-[3-(2,4-dimethylphenyl)-1H-pyrazole-5-carbonyl]piperazin-1-yl}(3,4,5-trimethoxyphenyl)methanone |
| Molecular Weight: | 478.55 |
| Molecular Formula: | C26 H30 N4 O5 |
| Smiles: | Cc1ccc(c(C)c1)c1cc(C(N2CCN(CC2)C(c2cc(c(c(c2)OC)OC)OC)=O)=O)[nH]n1 |
| Stereo: | ACHIRAL |
| logP: | 3.2772 |
| logD: | 3.2768 |
| logSw: | -3.3848 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.811 |
| InChI Key: | XCAZQGFLAXABBE-UHFFFAOYSA-N |