(1-benzothiophen-2-yl)(4-{7-[3-(trifluoromethyl)phenyl][1,2,4]triazolo[1,5-a]pyrimidin-2-yl}piperazin-1-yl)methanone
Chemical Structure Depiction of
(1-benzothiophen-2-yl)(4-{7-[3-(trifluoromethyl)phenyl][1,2,4]triazolo[1,5-a]pyrimidin-2-yl}piperazin-1-yl)methanone
(1-benzothiophen-2-yl)(4-{7-[3-(trifluoromethyl)phenyl][1,2,4]triazolo[1,5-a]pyrimidin-2-yl}piperazin-1-yl)methanone
Compound characteristics
| Compound ID: | V008-9666 |
| Compound Name: | (1-benzothiophen-2-yl)(4-{7-[3-(trifluoromethyl)phenyl][1,2,4]triazolo[1,5-a]pyrimidin-2-yl}piperazin-1-yl)methanone |
| Molecular Weight: | 508.52 |
| Molecular Formula: | C25 H19 F3 N6 O S |
| Salt: | not_available |
| Smiles: | C1CN(CCN1C(c1cc2ccccc2s1)=O)c1nc2nccc(c3cccc(c3)C(F)(F)F)n2n1 |
| Stereo: | ACHIRAL |
| logP: | 5.3483 |
| logD: | 5.348 |
| logSw: | -6.2378 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 49.796 |
| InChI Key: | BWHBSXHGCCFGBR-UHFFFAOYSA-N |