ethyl 1-(2-chlorophenyl)-5-{4-[4-(3-methylbutanoyl)piperazin-1-yl]phenyl}-1H-pyrazole-3-carboxylate
Chemical Structure Depiction of
ethyl 1-(2-chlorophenyl)-5-{4-[4-(3-methylbutanoyl)piperazin-1-yl]phenyl}-1H-pyrazole-3-carboxylate
ethyl 1-(2-chlorophenyl)-5-{4-[4-(3-methylbutanoyl)piperazin-1-yl]phenyl}-1H-pyrazole-3-carboxylate
Compound characteristics
| Compound ID: | V009-7867 |
| Compound Name: | ethyl 1-(2-chlorophenyl)-5-{4-[4-(3-methylbutanoyl)piperazin-1-yl]phenyl}-1H-pyrazole-3-carboxylate |
| Molecular Weight: | 495.02 |
| Molecular Formula: | C27 H31 Cl N4 O3 |
| Salt: | not_available |
| Smiles: | CCOC(c1cc(c2ccc(cc2)N2CCN(CC2)C(CC(C)C)=O)n(c2ccccc2[Cl])n1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.3926 |
| logD: | 5.3926 |
| logSw: | -5.9639 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 53.167 |
| InChI Key: | DPFOUBGMTCIZPZ-UHFFFAOYSA-N |