3-(4-{2-(4-chlorophenyl)-2-[(3-methylphenyl)methoxy]ethyl}piperazine-1-carbonyl)benzonitrile
Chemical Structure Depiction of
3-(4-{2-(4-chlorophenyl)-2-[(3-methylphenyl)methoxy]ethyl}piperazine-1-carbonyl)benzonitrile
3-(4-{2-(4-chlorophenyl)-2-[(3-methylphenyl)methoxy]ethyl}piperazine-1-carbonyl)benzonitrile
Compound characteristics
| Compound ID: | V001-8979 |
| Compound Name: | 3-(4-{2-(4-chlorophenyl)-2-[(3-methylphenyl)methoxy]ethyl}piperazine-1-carbonyl)benzonitrile |
| Molecular Weight: | 474 |
| Molecular Formula: | C28 H28 Cl N3 O2 |
| Salt: | not_available |
| Smiles: | Cc1cccc(COC(CN2CCN(CC2)C(c2cccc(C#N)c2)=O)c2ccc(cc2)[Cl])c1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.6716 |
| logD: | 4.6688 |
| logSw: | -5.0403 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 44.364 |
| InChI Key: | POGVTYMQYLSIST-MHZLTWQESA-N |