4-[4-(2,4-dimethylbenzoyl)-2-(methoxymethyl)piperazin-1-yl]-2-(trifluoromethyl)benzonitrile
Chemical Structure Depiction of
4-[4-(2,4-dimethylbenzoyl)-2-(methoxymethyl)piperazin-1-yl]-2-(trifluoromethyl)benzonitrile
4-[4-(2,4-dimethylbenzoyl)-2-(methoxymethyl)piperazin-1-yl]-2-(trifluoromethyl)benzonitrile
Compound characteristics
| Compound ID: | S956-5161 |
| Compound Name: | 4-[4-(2,4-dimethylbenzoyl)-2-(methoxymethyl)piperazin-1-yl]-2-(trifluoromethyl)benzonitrile |
| Molecular Weight: | 431.46 |
| Molecular Formula: | C23 H24 F3 N3 O2 |
| Smiles: | Cc1ccc(C(N2CCN(C(C2)COC)c2ccc(C#N)c(c2)C(F)(F)F)=O)c(C)c1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.1251 |
| logD: | 4.1251 |
| logSw: | -4.2176 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 45.207 |
| InChI Key: | ADZSHXZWHVZIAZ-LJQANCHMSA-N |