4-[4-(2-fluorobenzoyl)-3-{[(pyridin-3-yl)oxy]methyl}piperazin-1-yl]-2-(trifluoromethyl)benzonitrile
Chemical Structure Depiction of
4-[4-(2-fluorobenzoyl)-3-{[(pyridin-3-yl)oxy]methyl}piperazin-1-yl]-2-(trifluoromethyl)benzonitrile
4-[4-(2-fluorobenzoyl)-3-{[(pyridin-3-yl)oxy]methyl}piperazin-1-yl]-2-(trifluoromethyl)benzonitrile
Compound characteristics
| Compound ID: | S956-0426 |
| Compound Name: | 4-[4-(2-fluorobenzoyl)-3-{[(pyridin-3-yl)oxy]methyl}piperazin-1-yl]-2-(trifluoromethyl)benzonitrile |
| Molecular Weight: | 484.45 |
| Molecular Formula: | C25 H20 F4 N4 O2 |
| Smiles: | C1CN(C(CN1c1ccc(C#N)c(c1)C(F)(F)F)COc1cccnc1)C(c1ccccc1F)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.8396 |
| logD: | 3.832 |
| logSw: | -3.9956 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 53.528 |
| InChI Key: | FJGPTZZMMMNCCC-LJQANCHMSA-N |