methyl [7-oxo-2-(trifluoromethyl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-5-yl]acetate
Chemical Structure Depiction of
methyl [7-oxo-2-(trifluoromethyl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-5-yl]acetate
methyl [7-oxo-2-(trifluoromethyl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-5-yl]acetate
Compound characteristics
| Compound ID: | 8017-5760 |
| Compound Name: | methyl [7-oxo-2-(trifluoromethyl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-5-yl]acetate |
| Molecular Weight: | 276.17 |
| Molecular Formula: | C9 H7 F3 N4 O3 |
| Smiles: | COC(CC1=CC(n2c(N1)nc(C(F)(F)F)n2)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.5197 |
| logD: | -4.5995 |
| logSw: | -1.5422 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.191 |
| InChI Key: | SUJLASSQQNRVOT-UHFFFAOYSA-N |