2-({1-[3-(3,5-dimethylphenoxy)-2-hydroxypropyl]piperidin-4-yl}methyl)-1H-benzo[de]isoquinoline-1,3(2H)-dione
Chemical Structure Depiction of
2-({1-[3-(3,5-dimethylphenoxy)-2-hydroxypropyl]piperidin-4-yl}methyl)-1H-benzo[de]isoquinoline-1,3(2H)-dione
2-({1-[3-(3,5-dimethylphenoxy)-2-hydroxypropyl]piperidin-4-yl}methyl)-1H-benzo[de]isoquinoline-1,3(2H)-dione
Compound characteristics
| Compound ID: | 3343-3133 |
| Compound Name: | 2-({1-[3-(3,5-dimethylphenoxy)-2-hydroxypropyl]piperidin-4-yl}methyl)-1H-benzo[de]isoquinoline-1,3(2H)-dione |
| Molecular Weight: | 509.05 |
| Molecular Formula: | C29 H32 N2 O4 |
| Salt: | HCl |
| Smiles: | Cc1cc(C)cc(c1)OCC(CN1CCC(CC1)CN1C(c2cccc3cccc(C1=O)c23)=O)O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.2713 |
| logD: | 3.2555 |
| logSw: | -5.9013 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.705 |
| InChI Key: | FRBVGIBVLCZGTH-QHCPKHFHSA-N |