4-{4-[(2-chlorophenyl)acetyl]-2-(methoxymethyl)piperazin-1-yl}-2-(trifluoromethyl)benzonitrile
Chemical Structure Depiction of
4-{4-[(2-chlorophenyl)acetyl]-2-(methoxymethyl)piperazin-1-yl}-2-(trifluoromethyl)benzonitrile
4-{4-[(2-chlorophenyl)acetyl]-2-(methoxymethyl)piperazin-1-yl}-2-(trifluoromethyl)benzonitrile
Compound characteristics
| Compound ID: | S956-5196 |
| Compound Name: | 4-{4-[(2-chlorophenyl)acetyl]-2-(methoxymethyl)piperazin-1-yl}-2-(trifluoromethyl)benzonitrile |
| Molecular Weight: | 451.87 |
| Molecular Formula: | C22 H21 Cl F3 N3 O2 |
| Smiles: | COCC1CN(CCN1c1ccc(C#N)c(c1)C(F)(F)F)C(Cc1ccccc1[Cl])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.1246 |
| logD: | 4.1246 |
| logSw: | -4.412 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 44.679 |
| InChI Key: | IZCPCYCNGFNBEK-GOSISDBHSA-N |