ethyl 1-(2-chlorophenyl)-5-{4-[4-(5-methoxy-5-oxopentanoyl)piperazin-1-yl]phenyl}-1H-pyrazole-3-carboxylate
Chemical Structure Depiction of
ethyl 1-(2-chlorophenyl)-5-{4-[4-(5-methoxy-5-oxopentanoyl)piperazin-1-yl]phenyl}-1H-pyrazole-3-carboxylate
ethyl 1-(2-chlorophenyl)-5-{4-[4-(5-methoxy-5-oxopentanoyl)piperazin-1-yl]phenyl}-1H-pyrazole-3-carboxylate
Compound characteristics
| Compound ID: | V008-2756 |
| Compound Name: | ethyl 1-(2-chlorophenyl)-5-{4-[4-(5-methoxy-5-oxopentanoyl)piperazin-1-yl]phenyl}-1H-pyrazole-3-carboxylate |
| Molecular Weight: | 539.03 |
| Molecular Formula: | C28 H31 Cl N4 O5 |
| Salt: | not_available |
| Smiles: | CCOC(c1cc(c2ccc(cc2)N2CCN(CC2)C(CCCC(=O)OC)=O)n(c2ccccc2[Cl])n1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1943 |
| logD: | 4.1943 |
| logSw: | -4.5204 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 73.746 |
| InChI Key: | XNJJAIUKXMCWGU-UHFFFAOYSA-N |