7-(difluoromethyl)-N-(3-methoxy-5-nitrophenyl)-5-methyl[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide
Chemical Structure Depiction of
7-(difluoromethyl)-N-(3-methoxy-5-nitrophenyl)-5-methyl[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide
7-(difluoromethyl)-N-(3-methoxy-5-nitrophenyl)-5-methyl[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide
Compound characteristics
| Compound ID: | Y500-7846 |
| Compound Name: | 7-(difluoromethyl)-N-(3-methoxy-5-nitrophenyl)-5-methyl[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide |
| Molecular Weight: | 378.29 |
| Molecular Formula: | C15 H12 F2 N6 O4 |
| Smiles: | Cc1cc(C(F)F)n2c(n1)nc(C(Nc1cc(cc(c1)OC)[N+]([O-])=O)=O)n2 |
| Stereo: | ACHIRAL |
| logP: | 2.0917 |
| logD: | 2.0482 |
| logSw: | -2.6737 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 93.876 |
| InChI Key: | PCVRIKFKYMZQCY-UHFFFAOYSA-N |