4-[(2-{4-[(benzyloxy)acetyl]piperazin-1-yl}-1-[3-(pyrrolidin-1-yl)phenyl]ethoxy)methyl]benzonitrile
Chemical Structure Depiction of
4-[(2-{4-[(benzyloxy)acetyl]piperazin-1-yl}-1-[3-(pyrrolidin-1-yl)phenyl]ethoxy)methyl]benzonitrile
4-[(2-{4-[(benzyloxy)acetyl]piperazin-1-yl}-1-[3-(pyrrolidin-1-yl)phenyl]ethoxy)methyl]benzonitrile
Compound characteristics
| Compound ID: | V002-0073 |
| Compound Name: | 4-[(2-{4-[(benzyloxy)acetyl]piperazin-1-yl}-1-[3-(pyrrolidin-1-yl)phenyl]ethoxy)methyl]benzonitrile |
| Molecular Weight: | 538.69 |
| Molecular Formula: | C33 H38 N4 O3 |
| Salt: | not_available |
| Smiles: | C1CCN(C1)c1cccc(c1)C(CN1CCN(CC1)C(COCc1ccccc1)=O)OCc1ccc(C#N)cc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.0286 |
| logD: | 4.025 |
| logSw: | -4.2741 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 56.089 |
| InChI Key: | BYJPFHBSXLGPSS-YTTGMZPUSA-N |