2-(2-{4-[2-hydroxy-3-(3-methoxyphenoxy)propyl]piperazin-1-yl}ethyl)-1H-benzo[de]isoquinoline-1,3(2H)-dione--hydrogen chloride (1/1)
Chemical Structure Depiction of
2-(2-{4-[2-hydroxy-3-(3-methoxyphenoxy)propyl]piperazin-1-yl}ethyl)-1H-benzo[de]isoquinoline-1,3(2H)-dione--hydrogen chloride (1/1)
2-(2-{4-[2-hydroxy-3-(3-methoxyphenoxy)propyl]piperazin-1-yl}ethyl)-1H-benzo[de]isoquinoline-1,3(2H)-dione--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | 3343-2959 |
| Compound Name: | 2-(2-{4-[2-hydroxy-3-(3-methoxyphenoxy)propyl]piperazin-1-yl}ethyl)-1H-benzo[de]isoquinoline-1,3(2H)-dione--hydrogen chloride (1/1) |
| Molecular Weight: | 526.03 |
| Molecular Formula: | C28 H31 N3 O5 |
| Salt: | HCl |
| Smiles: | COc1cccc(c1)OCC(CN1CCN(CC1)CCN1C(c2cccc3cccc(C1=O)c23)=O)O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.1332 |
| logD: | 3.0563 |
| logSw: | -3.681 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.018 |
| InChI Key: | OKNILWKYNFQNKR-NRFANRHFSA-N |