2-({1-[3-(2,6-dimethoxyphenoxy)-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-(2,6-dimethoxyphenoxy)-2-hydroxypropyl]piperidin-4-yl}methyl)-1H-benzo[de]isoquinoline-1,3(2H)-dione--hydrogen chloride (1/1)
2-({1-[3-(2,6-dimethoxyphenoxy)-2-hydroxypropyl]piperidin-4-yl}methyl)-1H-benzo[de]isoquinoline-1,3(2H)-dione--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | 3343-3131 |
| Compound Name: | 2-({1-[3-(2,6-dimethoxyphenoxy)-2-hydroxypropyl]piperidin-4-yl}methyl)-1H-benzo[de]isoquinoline-1,3(2H)-dione--hydrogen chloride (1/1) |
| Molecular Weight: | 541.04 |
| Molecular Formula: | C29 H32 N2 O6 |
| Salt: | HCl |
| Smiles: | COc1cccc(c1OCC(CN1CCC(CC1)CN1C(c2cccc3cccc(C1=O)c23)=O)O)OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.8978 |
| logD: | 1.8821 |
| logSw: | -4.2353 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.139 |
| InChI Key: | ZEDMVKJKXPZXNI-NRFANRHFSA-N |