4-[4-(3-fluoro-4-methoxybenzoyl)-3-(methoxymethyl)piperazin-1-yl]-2-(trifluoromethyl)benzonitrile
Chemical Structure Depiction of
4-[4-(3-fluoro-4-methoxybenzoyl)-3-(methoxymethyl)piperazin-1-yl]-2-(trifluoromethyl)benzonitrile
4-[4-(3-fluoro-4-methoxybenzoyl)-3-(methoxymethyl)piperazin-1-yl]-2-(trifluoromethyl)benzonitrile
Compound characteristics
| Compound ID: | S956-0160 |
| Compound Name: | 4-[4-(3-fluoro-4-methoxybenzoyl)-3-(methoxymethyl)piperazin-1-yl]-2-(trifluoromethyl)benzonitrile |
| Molecular Weight: | 451.42 |
| Molecular Formula: | C22 H21 F4 N3 O3 |
| Smiles: | COCC1CN(CCN1C(c1ccc(c(c1)F)OC)=O)c1ccc(C#N)c(c1)C(F)(F)F |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.31 |
| logD: | 3.31 |
| logSw: | -3.586 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 52.837 |
| InChI Key: | UXJYZGBUJZGGNX-QGZVFWFLSA-N |