{4-[7-(3,4-dichlorophenyl)[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]piperazin-1-yl}[2-fluoro-4-(trifluoromethyl)phenyl]methanone
Chemical Structure Depiction of
{4-[7-(3,4-dichlorophenyl)[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]piperazin-1-yl}[2-fluoro-4-(trifluoromethyl)phenyl]methanone
{4-[7-(3,4-dichlorophenyl)[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]piperazin-1-yl}[2-fluoro-4-(trifluoromethyl)phenyl]methanone
Compound characteristics
| Compound ID: | V004-0346 |
| Compound Name: | {4-[7-(3,4-dichlorophenyl)[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]piperazin-1-yl}[2-fluoro-4-(trifluoromethyl)phenyl]methanone |
| Molecular Weight: | 539.32 |
| Molecular Formula: | C23 H16 Cl2 F4 N6 O |
| Salt: | not_available |
| Smiles: | C1CN(CCN1C(c1ccc(cc1F)C(F)(F)F)=O)c1nc2nccc(c3ccc(c(c3)[Cl])[Cl])n2n1 |
| Stereo: | ACHIRAL |
| logP: | 5.6244 |
| logD: | 5.6243 |
| logSw: | -6.1092 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 49.049 |
| InChI Key: | MYEBHVBYNGGIII-UHFFFAOYSA-N |