4-{[2-{4-[(3,4-dimethoxyphenyl)acetyl]piperazin-1-yl}-1-(3-methoxyphenyl)ethoxy]methyl}benzonitrile
Chemical Structure Depiction of
4-{[2-{4-[(3,4-dimethoxyphenyl)acetyl]piperazin-1-yl}-1-(3-methoxyphenyl)ethoxy]methyl}benzonitrile
4-{[2-{4-[(3,4-dimethoxyphenyl)acetyl]piperazin-1-yl}-1-(3-methoxyphenyl)ethoxy]methyl}benzonitrile
Compound characteristics
| Compound ID: | V002-0206 |
| Compound Name: | 4-{[2-{4-[(3,4-dimethoxyphenyl)acetyl]piperazin-1-yl}-1-(3-methoxyphenyl)ethoxy]methyl}benzonitrile |
| Molecular Weight: | 529.64 |
| Molecular Formula: | C31 H35 N3 O5 |
| Salt: | not_available |
| Smiles: | COc1cccc(c1)C(CN1CCN(CC1)C(Cc1ccc(c(c1)OC)OC)=O)OCc1ccc(C#N)cc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.4978 |
| logD: | 3.4948 |
| logSw: | -3.6627 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 66.641 |
| InChI Key: | IJSRSCQHMFNZAB-PMERELPUSA-N |