2-(3,4-dimethoxyphenyl)-N-{2-[4-(pyrimidin-2-yl)piperazine-1-carbonyl]-1-benzofuran-3-yl}acetamide
Chemical Structure Depiction of
2-(3,4-dimethoxyphenyl)-N-{2-[4-(pyrimidin-2-yl)piperazine-1-carbonyl]-1-benzofuran-3-yl}acetamide
2-(3,4-dimethoxyphenyl)-N-{2-[4-(pyrimidin-2-yl)piperazine-1-carbonyl]-1-benzofuran-3-yl}acetamide
Compound characteristics
| Compound ID: | E002-2686 |
| Compound Name: | 2-(3,4-dimethoxyphenyl)-N-{2-[4-(pyrimidin-2-yl)piperazine-1-carbonyl]-1-benzofuran-3-yl}acetamide |
| Molecular Weight: | 501.54 |
| Molecular Formula: | C27 H27 N5 O5 |
| Smiles: | COc1ccc(CC(Nc2c3ccccc3oc2C(N2CCN(CC2)c2ncccn2)=O)=O)cc1OC |
| Stereo: | ACHIRAL |
| logP: | 2.9375 |
| logD: | 2.8519 |
| logSw: | -3.2793 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 83.778 |
| InChI Key: | GOYLTMCNEVADIE-UHFFFAOYSA-N |