2~1~-[4-(4-chlorophenyl)-6-(trifluoromethyl)pyrimidin-2-yl]-1~1~,1~5~,2~4~,3~1~,3~5~-pentamethyl-1~1~H,2~1~H,3~1~H-1~4~,2~3~:2~5~,3~4~-terpyrazole
Chemical Structure Depiction of
2~1~-[4-(4-chlorophenyl)-6-(trifluoromethyl)pyrimidin-2-yl]-1~1~,1~5~,2~4~,3~1~,3~5~-pentamethyl-1~1~H,2~1~H,3~1~H-1~4~,2~3~:2~5~,3~4~-terpyrazole
2~1~-[4-(4-chlorophenyl)-6-(trifluoromethyl)pyrimidin-2-yl]-1~1~,1~5~,2~4~,3~1~,3~5~-pentamethyl-1~1~H,2~1~H,3~1~H-1~4~,2~3~:2~5~,3~4~-terpyrazole
Compound characteristics
| Compound ID: | Y505-7078 |
| Compound Name: | 2~1~-[4-(4-chlorophenyl)-6-(trifluoromethyl)pyrimidin-2-yl]-1~1~,1~5~,2~4~,3~1~,3~5~-pentamethyl-1~1~H,2~1~H,3~1~H-1~4~,2~3~:2~5~,3~4~-terpyrazole |
| Molecular Weight: | 526.95 |
| Molecular Formula: | C25 H22 Cl F3 N8 |
| Smiles: | Cc1c(c2cnn(C)c2C)nn(c2nc(cc(C(F)(F)F)n2)c2ccc(cc2)[Cl])c1c1cnn(C)c1C |
| Stereo: | ACHIRAL |
| logP: | 5.4285 |
| logD: | 5.4281 |
| logSw: | -6.2118 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 59.536 |
| InChI Key: | WAWXEKUPXVYBKT-UHFFFAOYSA-N |