7-(difluoromethyl)-5-methyl-N-[3-nitro-5-(2,2,2-trifluoroethoxy)phenyl][1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide
Chemical Structure Depiction of
7-(difluoromethyl)-5-methyl-N-[3-nitro-5-(2,2,2-trifluoroethoxy)phenyl][1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide
7-(difluoromethyl)-5-methyl-N-[3-nitro-5-(2,2,2-trifluoroethoxy)phenyl][1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide
Compound characteristics
| Compound ID: | Y500-7650 |
| Compound Name: | 7-(difluoromethyl)-5-methyl-N-[3-nitro-5-(2,2,2-trifluoroethoxy)phenyl][1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide |
| Molecular Weight: | 446.29 |
| Molecular Formula: | C16 H11 F5 N6 O4 |
| Smiles: | Cc1cc(C(F)F)n2c(n1)nc(C(Nc1cc(cc(c1)OCC(F)(F)F)[N+]([O-])=O)=O)n2 |
| Stereo: | ACHIRAL |
| logP: | 2.8511 |
| logD: | 2.8076 |
| logSw: | -3.218 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 93.831 |
| InChI Key: | ALDSTRLGYORZNK-UHFFFAOYSA-N |