1-{4-[3-(4-chlorophenyl)-1H-pyrazole-5-carbonyl]piperazin-1-yl}-2-(3,4-dimethoxyphenyl)ethan-1-one
Chemical Structure Depiction of
1-{4-[3-(4-chlorophenyl)-1H-pyrazole-5-carbonyl]piperazin-1-yl}-2-(3,4-dimethoxyphenyl)ethan-1-one
1-{4-[3-(4-chlorophenyl)-1H-pyrazole-5-carbonyl]piperazin-1-yl}-2-(3,4-dimethoxyphenyl)ethan-1-one
Compound characteristics
| Compound ID: | E687-0443 |
| Compound Name: | 1-{4-[3-(4-chlorophenyl)-1H-pyrazole-5-carbonyl]piperazin-1-yl}-2-(3,4-dimethoxyphenyl)ethan-1-one |
| Molecular Weight: | 468.94 |
| Molecular Formula: | C24 H25 Cl N4 O4 |
| Smiles: | COc1ccc(CC(N2CCN(CC2)C(c2cc(c3ccc(cc3)[Cl])n[nH]2)=O)=O)cc1OC |
| Stereo: | ACHIRAL |
| logP: | 3.3602 |
| logD: | 3.3597 |
| logSw: | -3.8435 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.566 |
| InChI Key: | RWPHSQLPAAAQGX-UHFFFAOYSA-N |