2-[(1-{3-[(3,4-dimethoxyphenyl)methoxy]-2-hydroxypropyl}piperidin-4-yl)methyl]-1H-benzo[de]isoquinoline-1,3(2H)-dione--hydrogen chloride (1/1)
Chemical Structure Depiction of
2-[(1-{3-[(3,4-dimethoxyphenyl)methoxy]-2-hydroxypropyl}piperidin-4-yl)methyl]-1H-benzo[de]isoquinoline-1,3(2H)-dione--hydrogen chloride (1/1)
2-[(1-{3-[(3,4-dimethoxyphenyl)methoxy]-2-hydroxypropyl}piperidin-4-yl)methyl]-1H-benzo[de]isoquinoline-1,3(2H)-dione--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | 3343-3111 |
| Compound Name: | 2-[(1-{3-[(3,4-dimethoxyphenyl)methoxy]-2-hydroxypropyl}piperidin-4-yl)methyl]-1H-benzo[de]isoquinoline-1,3(2H)-dione--hydrogen chloride (1/1) |
| Molecular Weight: | 555.07 |
| Molecular Formula: | C30 H34 N2 O6 |
| Salt: | HCl |
| Smiles: | COc1ccc(COCC(CN2CCC(CC2)CN2C(c3cccc4cccc(C2=O)c34)=O)O)cc1OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.7818 |
| logD: | 1.7367 |
| logSw: | -4.228 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.901 |
| InChI Key: | WXIVAIPFVFMLTF-QHCPKHFHSA-N |