{4-[3-(2,4-dimethylphenyl)-1H-pyrazole-5-carbonyl]piperazin-1-yl}(furan-2-yl)methanone
Chemical Structure Depiction of
{4-[3-(2,4-dimethylphenyl)-1H-pyrazole-5-carbonyl]piperazin-1-yl}(furan-2-yl)methanone
{4-[3-(2,4-dimethylphenyl)-1H-pyrazole-5-carbonyl]piperazin-1-yl}(furan-2-yl)methanone
Compound characteristics
| Compound ID: | E614-0409 |
| Compound Name: | {4-[3-(2,4-dimethylphenyl)-1H-pyrazole-5-carbonyl]piperazin-1-yl}(furan-2-yl)methanone |
| Molecular Weight: | 378.43 |
| Molecular Formula: | C21 H22 N4 O3 |
| Smiles: | Cc1ccc(c(C)c1)c1cc(C(N2CCN(CC2)C(c2ccco2)=O)=O)[nH]n1 |
| Stereo: | ACHIRAL |
| logP: | 2.979 |
| logD: | 2.9787 |
| logSw: | -3.0933 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.411 |
| InChI Key: | ITZYAAQXIPNISB-UHFFFAOYSA-N |