2,2-dichloro-1-(4-{7-[3-(trifluoromethyl)phenyl][1,2,4]triazolo[1,5-a]pyrimidin-2-yl}piperazin-1-yl)ethan-1-one
Chemical Structure Depiction of
2,2-dichloro-1-(4-{7-[3-(trifluoromethyl)phenyl][1,2,4]triazolo[1,5-a]pyrimidin-2-yl}piperazin-1-yl)ethan-1-one
2,2-dichloro-1-(4-{7-[3-(trifluoromethyl)phenyl][1,2,4]triazolo[1,5-a]pyrimidin-2-yl}piperazin-1-yl)ethan-1-one
Compound characteristics
| Compound ID: | V008-1238 |
| Compound Name: | 2,2-dichloro-1-(4-{7-[3-(trifluoromethyl)phenyl][1,2,4]triazolo[1,5-a]pyrimidin-2-yl}piperazin-1-yl)ethan-1-one |
| Molecular Weight: | 459.26 |
| Molecular Formula: | C18 H15 Cl2 F3 N6 O |
| Salt: | not_available |
| Smiles: | C1CN(CCN1C(C([Cl])[Cl])=O)c1nc2nccc(c3cccc(c3)C(F)(F)F)n2n1 |
| Stereo: | ACHIRAL |
| logP: | 3.2466 |
| logD: | 3.2465 |
| logSw: | -3.3073 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 49.32 |
| InChI Key: | LSQZGZUIPCYDEP-UHFFFAOYSA-N |