2-(3-chloro-4-methoxyphenyl)-1-{4-[5-(pyridin-4-yl)-1H-pyrazole-3-carbonyl]piperazin-1-yl}ethan-1-one
Chemical Structure Depiction of
2-(3-chloro-4-methoxyphenyl)-1-{4-[5-(pyridin-4-yl)-1H-pyrazole-3-carbonyl]piperazin-1-yl}ethan-1-one
2-(3-chloro-4-methoxyphenyl)-1-{4-[5-(pyridin-4-yl)-1H-pyrazole-3-carbonyl]piperazin-1-yl}ethan-1-one
Compound characteristics
| Compound ID: | G639-3509 |
| Compound Name: | 2-(3-chloro-4-methoxyphenyl)-1-{4-[5-(pyridin-4-yl)-1H-pyrazole-3-carbonyl]piperazin-1-yl}ethan-1-one |
| Molecular Weight: | 439.9 |
| Molecular Formula: | C22 H22 Cl N5 O3 |
| Smiles: | COc1ccc(CC(N2CCN(CC2)C(c2cc(c3ccncc3)[nH]n2)=O)=O)cc1[Cl] |
| Stereo: | ACHIRAL |
| logP: | 2.1633 |
| logD: | 2.162 |
| logSw: | -3.2147 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.364 |
| InChI Key: | CAKKOHMDIZQOIG-UHFFFAOYSA-N |