4-{[1-(3-methoxyphenyl)-2-{4-[(3-methoxyphenyl)acetyl]piperazin-1-yl}ethoxy]methyl}benzonitrile
Chemical Structure Depiction of
4-{[1-(3-methoxyphenyl)-2-{4-[(3-methoxyphenyl)acetyl]piperazin-1-yl}ethoxy]methyl}benzonitrile
4-{[1-(3-methoxyphenyl)-2-{4-[(3-methoxyphenyl)acetyl]piperazin-1-yl}ethoxy]methyl}benzonitrile
Compound characteristics
| Compound ID: | V002-0266 |
| Compound Name: | 4-{[1-(3-methoxyphenyl)-2-{4-[(3-methoxyphenyl)acetyl]piperazin-1-yl}ethoxy]methyl}benzonitrile |
| Molecular Weight: | 499.61 |
| Molecular Formula: | C30 H33 N3 O4 |
| Salt: | not_available |
| Smiles: | COc1cccc(CC(N2CCN(CC2)CC(c2cccc(c2)OC)OCc2ccc(C#N)cc2)=O)c1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.9802 |
| logD: | 3.9772 |
| logSw: | -4.2388 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 58.924 |
| InChI Key: | RKNFEWZAHZBLPI-LJAQVGFWSA-N |