4-[3-(methoxymethyl)-4-(4-methoxy-2-methylbenzoyl)piperazin-1-yl]-2-(trifluoromethyl)benzonitrile
Chemical Structure Depiction of
4-[3-(methoxymethyl)-4-(4-methoxy-2-methylbenzoyl)piperazin-1-yl]-2-(trifluoromethyl)benzonitrile
4-[3-(methoxymethyl)-4-(4-methoxy-2-methylbenzoyl)piperazin-1-yl]-2-(trifluoromethyl)benzonitrile
Compound characteristics
| Compound ID: | S956-0164 |
| Compound Name: | 4-[3-(methoxymethyl)-4-(4-methoxy-2-methylbenzoyl)piperazin-1-yl]-2-(trifluoromethyl)benzonitrile |
| Molecular Weight: | 447.46 |
| Molecular Formula: | C23 H24 F3 N3 O3 |
| Smiles: | Cc1cc(ccc1C(N1CCN(CC1COC)c1ccc(C#N)c(c1)C(F)(F)F)=O)OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.7686 |
| logD: | 3.7686 |
| logSw: | -4.0886 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 52.751 |
| InChI Key: | DTQGTPZMYQOOGQ-GOSISDBHSA-N |