ethyl 1-[3-(4-benzylpiperazin-1-yl)-3-oxopropyl]-5-(4-methoxyphenyl)-2-methyl-1H-pyrrole-3-carboxylate
Chemical Structure Depiction of
ethyl 1-[3-(4-benzylpiperazin-1-yl)-3-oxopropyl]-5-(4-methoxyphenyl)-2-methyl-1H-pyrrole-3-carboxylate
ethyl 1-[3-(4-benzylpiperazin-1-yl)-3-oxopropyl]-5-(4-methoxyphenyl)-2-methyl-1H-pyrrole-3-carboxylate
Compound characteristics
| Compound ID: | K906-2039 |
| Compound Name: | ethyl 1-[3-(4-benzylpiperazin-1-yl)-3-oxopropyl]-5-(4-methoxyphenyl)-2-methyl-1H-pyrrole-3-carboxylate |
| Molecular Weight: | 489.61 |
| Molecular Formula: | C29 H35 N3 O4 |
| Smiles: | CCOC(c1cc(c2ccc(cc2)OC)n(CCC(N2CCN(CC2)Cc2ccccc2)=O)c1C)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4225 |
| logD: | 4.3896 |
| logSw: | -4.2588 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 49.127 |
| InChI Key: | IPNWEBXXBZOWCY-UHFFFAOYSA-N |