ethyl 1-[2-(4-benzylpiperazin-1-yl)-2-oxoethyl]-2,4-dimethyl-5-phenyl-1H-pyrrole-3-carboxylate
Chemical Structure Depiction of
ethyl 1-[2-(4-benzylpiperazin-1-yl)-2-oxoethyl]-2,4-dimethyl-5-phenyl-1H-pyrrole-3-carboxylate
ethyl 1-[2-(4-benzylpiperazin-1-yl)-2-oxoethyl]-2,4-dimethyl-5-phenyl-1H-pyrrole-3-carboxylate
Compound characteristics
| Compound ID: | C721-0126 |
| Compound Name: | ethyl 1-[2-(4-benzylpiperazin-1-yl)-2-oxoethyl]-2,4-dimethyl-5-phenyl-1H-pyrrole-3-carboxylate |
| Molecular Weight: | 459.59 |
| Molecular Formula: | C28 H33 N3 O3 |
| Smiles: | CCOC(c1c(C)c(c2ccccc2)n(CC(N2CCN(CC2)Cc2ccccc2)=O)c1C)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8597 |
| logD: | 3.8443 |
| logSw: | -4.03 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 41.38 |
| InChI Key: | ALQUVBCLSZNFTC-UHFFFAOYSA-N |