N-[3-(4-fluorophenoxy)-5-nitrophenyl]-5-phenyl-7-(trifluoromethyl)[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide
Chemical Structure Depiction of
N-[3-(4-fluorophenoxy)-5-nitrophenyl]-5-phenyl-7-(trifluoromethyl)[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide
N-[3-(4-fluorophenoxy)-5-nitrophenyl]-5-phenyl-7-(trifluoromethyl)[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide
Compound characteristics
| Compound ID: | 1762-0039 |
| Compound Name: | N-[3-(4-fluorophenoxy)-5-nitrophenyl]-5-phenyl-7-(trifluoromethyl)[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide |
| Molecular Weight: | 538.42 |
| Molecular Formula: | C25 H14 F4 N6 O4 |
| Smiles: | c1ccc(cc1)c1cc(C(F)(F)F)n2c(n1)nc(C(Nc1cc(cc(c1)Oc1ccc(cc1)F)[N+]([O-])=O)=O)n2 |
| Stereo: | ACHIRAL |
| logP: | 6.2017 |
| logD: | 6.1975 |
| logSw: | -6.0239 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 93.002 |
| InChI Key: | ZMJJKBITYRGQEZ-UHFFFAOYSA-N |