4-[(2-{4-[(2-methoxyethoxy)acetyl]piperazin-1-yl}-1-[3-(pyrrolidin-1-yl)phenyl]ethoxy)methyl]benzonitrile
Chemical Structure Depiction of
4-[(2-{4-[(2-methoxyethoxy)acetyl]piperazin-1-yl}-1-[3-(pyrrolidin-1-yl)phenyl]ethoxy)methyl]benzonitrile
4-[(2-{4-[(2-methoxyethoxy)acetyl]piperazin-1-yl}-1-[3-(pyrrolidin-1-yl)phenyl]ethoxy)methyl]benzonitrile
Compound characteristics
| Compound ID: | V002-1281 |
| Compound Name: | 4-[(2-{4-[(2-methoxyethoxy)acetyl]piperazin-1-yl}-1-[3-(pyrrolidin-1-yl)phenyl]ethoxy)methyl]benzonitrile |
| Molecular Weight: | 506.65 |
| Molecular Formula: | C29 H38 N4 O4 |
| Salt: | not_available |
| Smiles: | COCCOCC(N1CCN(CC1)CC(c1cccc(c1)N1CCCC1)OCc1ccc(C#N)cc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.911 |
| logD: | 1.9073 |
| logSw: | -2.2688 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 64.622 |
| InChI Key: | QYRBADUCKBIJSM-NDEPHWFRSA-N |