4-(4-{7-[3-(trifluoromethyl)phenyl][1,2,4]triazolo[1,5-a]pyrimidin-2-yl}piperazine-1-carbonyl)benzonitrile
Chemical Structure Depiction of
4-(4-{7-[3-(trifluoromethyl)phenyl][1,2,4]triazolo[1,5-a]pyrimidin-2-yl}piperazine-1-carbonyl)benzonitrile
4-(4-{7-[3-(trifluoromethyl)phenyl][1,2,4]triazolo[1,5-a]pyrimidin-2-yl}piperazine-1-carbonyl)benzonitrile
Compound characteristics
| Compound ID: | V003-1320 |
| Compound Name: | 4-(4-{7-[3-(trifluoromethyl)phenyl][1,2,4]triazolo[1,5-a]pyrimidin-2-yl}piperazine-1-carbonyl)benzonitrile |
| Molecular Weight: | 477.45 |
| Molecular Formula: | C24 H18 F3 N7 O |
| Smiles: | C1CN(CCN1C(c1ccc(C#N)cc1)=O)c1nc2nccc(c3cccc(c3)C(F)(F)F)n2n1 |
| Stereo: | ACHIRAL |
| logP: | 3.4384 |
| logD: | 3.4383 |
| logSw: | -3.7244 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 66.105 |
| InChI Key: | HCGAHPKMICYPHN-UHFFFAOYSA-N |