4-[4-(furan-3-carbonyl)-3-{[(pyridin-3-yl)oxy]methyl}piperazin-1-yl]-2-(trifluoromethyl)benzonitrile
Chemical Structure Depiction of
4-[4-(furan-3-carbonyl)-3-{[(pyridin-3-yl)oxy]methyl}piperazin-1-yl]-2-(trifluoromethyl)benzonitrile
4-[4-(furan-3-carbonyl)-3-{[(pyridin-3-yl)oxy]methyl}piperazin-1-yl]-2-(trifluoromethyl)benzonitrile
Compound characteristics
| Compound ID: | S956-0416 |
| Compound Name: | 4-[4-(furan-3-carbonyl)-3-{[(pyridin-3-yl)oxy]methyl}piperazin-1-yl]-2-(trifluoromethyl)benzonitrile |
| Molecular Weight: | 456.42 |
| Molecular Formula: | C23 H19 F3 N4 O3 |
| Smiles: | C1CN(C(CN1c1ccc(C#N)c(c1)C(F)(F)F)COc1cccnc1)C(c1ccoc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.1246 |
| logD: | 3.117 |
| logSw: | -3.0955 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 61.332 |
| InChI Key: | HYZVTPHPVVKEDT-LJQANCHMSA-N |