4-(4-{2-(4-chlorophenyl)-2-[(3-methylphenyl)methoxy]ethyl}piperazine-1-carbonyl)benzonitrile
Chemical Structure Depiction of
4-(4-{2-(4-chlorophenyl)-2-[(3-methylphenyl)methoxy]ethyl}piperazine-1-carbonyl)benzonitrile
4-(4-{2-(4-chlorophenyl)-2-[(3-methylphenyl)methoxy]ethyl}piperazine-1-carbonyl)benzonitrile
Compound characteristics
| Compound ID: | V002-0245 |
| Compound Name: | 4-(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(c2ccc(C#N)cc2)=O)c2ccc(cc2)[Cl])c1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.7889 |
| logD: | 4.7861 |
| logSw: | -5.0748 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 44.364 |
| InChI Key: | DITSWZCUAJYKKV-MHZLTWQESA-N |