ethyl 6-bromo-5-methoxy-2-{[4-(2-methylphenyl)piperazin-1-yl]methyl}-1-benzofuran-3-carboxylate
Chemical Structure Depiction of
ethyl 6-bromo-5-methoxy-2-{[4-(2-methylphenyl)piperazin-1-yl]methyl}-1-benzofuran-3-carboxylate
ethyl 6-bromo-5-methoxy-2-{[4-(2-methylphenyl)piperazin-1-yl]methyl}-1-benzofuran-3-carboxylate
Compound characteristics
| Compound ID: | 4158-0912 |
| Compound Name: | ethyl 6-bromo-5-methoxy-2-{[4-(2-methylphenyl)piperazin-1-yl]methyl}-1-benzofuran-3-carboxylate |
| Molecular Weight: | 487.39 |
| Molecular Formula: | C24 H27 Br N2 O4 |
| Smiles: | CCOC(c1c2cc(c(cc2oc1CN1CCN(CC1)c1ccccc1C)[Br])OC)=O |
| Stereo: | ACHIRAL |
| logP: | 5.1908 |
| logD: | 3.8842 |
| logSw: | -5.2326 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 43.011 |
| InChI Key: | CSQQJNJFOOHFRI-UHFFFAOYSA-N |