(6-chloro-4H-1-benzopyran-3-yl)(4-{7-[3-(trifluoromethyl)phenyl][1,2,4]triazolo[1,5-a]pyrimidin-2-yl}piperazin-1-yl)methanone
Chemical Structure Depiction of
(6-chloro-4H-1-benzopyran-3-yl)(4-{7-[3-(trifluoromethyl)phenyl][1,2,4]triazolo[1,5-a]pyrimidin-2-yl}piperazin-1-yl)methanone
(6-chloro-4H-1-benzopyran-3-yl)(4-{7-[3-(trifluoromethyl)phenyl][1,2,4]triazolo[1,5-a]pyrimidin-2-yl}piperazin-1-yl)methanone
Compound characteristics
| Compound ID: | V002-8431 |
| Compound Name: | (6-chloro-4H-1-benzopyran-3-yl)(4-{7-[3-(trifluoromethyl)phenyl][1,2,4]triazolo[1,5-a]pyrimidin-2-yl}piperazin-1-yl)methanone |
| Molecular Weight: | 540.93 |
| Molecular Formula: | C26 H20 Cl F3 N6 O2 |
| Salt: | not_available |
| Smiles: | C1C(=COc2ccc(cc12)[Cl])C(N1CCN(CC1)c1nc2nccc(c3cccc(c3)C(F)(F)F)n2n1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.939 |
| logD: | 4.9348 |
| logSw: | -5.1773 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 56.795 |
| InChI Key: | LULUDDVONYLNSC-UHFFFAOYSA-N |