6-nitro-7-oxo-2-(trifluoromethyl)-7H-[1,2,4]triazolo[1,5-a]pyrimidin-4-ide
Chemical Structure Depiction of
6-nitro-7-oxo-2-(trifluoromethyl)-7H-[1,2,4]triazolo[1,5-a]pyrimidin-4-ide
6-nitro-7-oxo-2-(trifluoromethyl)-7H-[1,2,4]triazolo[1,5-a]pyrimidin-4-ide
Compound characteristics
| Compound ID: | 8015-2156 |
| Compound Name: | 6-nitro-7-oxo-2-(trifluoromethyl)-7H-[1,2,4]triazolo[1,5-a]pyrimidin-4-ide |
| Molecular Weight: | 271.09 |
| Molecular Formula: | C6 H F3 N5 O3 |
| Salt: | Na+ |
| Smiles: | C1=C(C(n2c([N-]1)nc(C(F)(F)F)n2)=O)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 0.5227 |
| logD: | 0.5227 |
| logSw: | -1.3321 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 83.869 |
| InChI Key: | ATWVKUWGUDUNQU-UHFFFAOYSA-M |