ethyl 5-hydroxy-4-[(4-methylpiperazin-1-yl)methyl]-2-phenyl-1-benzofuran-3-carboxylate--hydrogen chloride (1/1)
Chemical Structure Depiction of
ethyl 5-hydroxy-4-[(4-methylpiperazin-1-yl)methyl]-2-phenyl-1-benzofuran-3-carboxylate--hydrogen chloride (1/1)
ethyl 5-hydroxy-4-[(4-methylpiperazin-1-yl)methyl]-2-phenyl-1-benzofuran-3-carboxylate--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | 3570-0141 |
| Compound Name: | ethyl 5-hydroxy-4-[(4-methylpiperazin-1-yl)methyl]-2-phenyl-1-benzofuran-3-carboxylate--hydrogen chloride (1/1) |
| Molecular Weight: | 430.93 |
| Molecular Formula: | C23 H26 N2 O4 |
| Salt: | HCl |
| Smiles: | CCOC(c1c2c(CN3CCN(C)CC3)c(ccc2oc1c1ccccc1)O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7038 |
| logD: | 2.9048 |
| logSw: | -4.1254 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.004 |
| InChI Key: | JXOJPBJBHDCLFP-UHFFFAOYSA-N |