ethyl 5-{4-[4-(3-cyanobenzoyl)piperazin-1-yl]phenyl}-1-(pyridin-2-yl)-1H-pyrazole-3-carboxylate
Chemical Structure Depiction of
ethyl 5-{4-[4-(3-cyanobenzoyl)piperazin-1-yl]phenyl}-1-(pyridin-2-yl)-1H-pyrazole-3-carboxylate
ethyl 5-{4-[4-(3-cyanobenzoyl)piperazin-1-yl]phenyl}-1-(pyridin-2-yl)-1H-pyrazole-3-carboxylate
Compound characteristics
| Compound ID: | V016-7696 |
| Compound Name: | ethyl 5-{4-[4-(3-cyanobenzoyl)piperazin-1-yl]phenyl}-1-(pyridin-2-yl)-1H-pyrazole-3-carboxylate |
| Molecular Weight: | 506.56 |
| Molecular Formula: | C29 H26 N6 O3 |
| Salt: | not_available |
| Smiles: | CCOC(c1cc(c2ccc(cc2)N2CCN(CC2)C(c2cccc(C#N)c2)=O)n(c2ccccn2)n1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9846 |
| logD: | 3.9845 |
| logSw: | -4.0812 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 79.291 |
| InChI Key: | NLGWTXLDGHDWTC-UHFFFAOYSA-N |