methyl 1-[2-(4-benzylpiperazin-1-yl)-2-oxoethyl]-5-(furan-2-yl)-1H-pyrrole-2-carboxylate
Chemical Structure Depiction of
methyl 1-[2-(4-benzylpiperazin-1-yl)-2-oxoethyl]-5-(furan-2-yl)-1H-pyrrole-2-carboxylate
methyl 1-[2-(4-benzylpiperazin-1-yl)-2-oxoethyl]-5-(furan-2-yl)-1H-pyrrole-2-carboxylate
Compound characteristics
| Compound ID: | E222-0031 |
| Compound Name: | methyl 1-[2-(4-benzylpiperazin-1-yl)-2-oxoethyl]-5-(furan-2-yl)-1H-pyrrole-2-carboxylate |
| Molecular Weight: | 407.47 |
| Molecular Formula: | C23 H25 N3 O4 |
| Smiles: | COC(c1ccc(c2ccco2)n1CC(N1CCN(CC1)Cc1ccccc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.4969 |
| logD: | 2.4814 |
| logSw: | -2.282 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 49.856 |
| InChI Key: | NNBSWAKHJUOURK-UHFFFAOYSA-N |