4-{2-(4-chlorophenyl)-2-[(3-methylphenyl)methoxy]ethyl}-N-(3-cyanophenyl)piperazine-1-carboxamide
Chemical Structure Depiction of
4-{2-(4-chlorophenyl)-2-[(3-methylphenyl)methoxy]ethyl}-N-(3-cyanophenyl)piperazine-1-carboxamide
4-{2-(4-chlorophenyl)-2-[(3-methylphenyl)methoxy]ethyl}-N-(3-cyanophenyl)piperazine-1-carboxamide
Compound characteristics
| Compound ID: | V002-0951 |
| Compound Name: | 4-{2-(4-chlorophenyl)-2-[(3-methylphenyl)methoxy]ethyl}-N-(3-cyanophenyl)piperazine-1-carboxamide |
| Molecular Weight: | 489.02 |
| Molecular Formula: | C28 H29 Cl N4 O2 |
| Salt: | not_available |
| Smiles: | Cc1cccc(COC(CN2CCN(CC2)C(Nc2cccc(C#N)c2)=O)c2ccc(cc2)[Cl])c1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.3558 |
| logD: | 5.2904 |
| logSw: | -6.0918 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.185 |
| InChI Key: | IQSFJJHZIPNUNL-MHZLTWQESA-N |