ethyl 1-[4-(4-benzylpiperazin-1-yl)-4-oxobutyl]-5-(4-methylphenyl)-1H-pyrrole-3-carboxylate
Chemical Structure Depiction of
ethyl 1-[4-(4-benzylpiperazin-1-yl)-4-oxobutyl]-5-(4-methylphenyl)-1H-pyrrole-3-carboxylate
ethyl 1-[4-(4-benzylpiperazin-1-yl)-4-oxobutyl]-5-(4-methylphenyl)-1H-pyrrole-3-carboxylate
Compound characteristics
| Compound ID: | K906-3197 |
| Compound Name: | ethyl 1-[4-(4-benzylpiperazin-1-yl)-4-oxobutyl]-5-(4-methylphenyl)-1H-pyrrole-3-carboxylate |
| Molecular Weight: | 473.62 |
| Molecular Formula: | C29 H35 N3 O3 |
| Smiles: | CCOC(c1cc(c2ccc(C)cc2)n(CCCC(N2CCN(CC2)Cc2ccccc2)=O)c1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5864 |
| logD: | 4.5535 |
| logSw: | -4.2464 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 42.114 |
| InChI Key: | KAKZUBPQLJHKMW-UHFFFAOYSA-N |