2-(5-methyl-3-oxo-7-phenyl[1,2,4]triazolo[4,3-c]pyrimidin-2(3H)-yl)-N-[4-(trifluoromethyl)phenyl]acetamide
Chemical Structure Depiction of
2-(5-methyl-3-oxo-7-phenyl[1,2,4]triazolo[4,3-c]pyrimidin-2(3H)-yl)-N-[4-(trifluoromethyl)phenyl]acetamide
2-(5-methyl-3-oxo-7-phenyl[1,2,4]triazolo[4,3-c]pyrimidin-2(3H)-yl)-N-[4-(trifluoromethyl)phenyl]acetamide
Compound characteristics
| Compound ID: | P032-2116 |
| Compound Name: | 2-(5-methyl-3-oxo-7-phenyl[1,2,4]triazolo[4,3-c]pyrimidin-2(3H)-yl)-N-[4-(trifluoromethyl)phenyl]acetamide |
| Molecular Weight: | 427.38 |
| Molecular Formula: | C21 H16 F3 N5 O2 |
| Smiles: | CC1=NC(=CC2=NN(CC(Nc3ccc(cc3)C(F)(F)F)=O)C(N12)=O)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 3.8066 |
| logD: | 3.7961 |
| logSw: | -4.0439 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.139 |
| InChI Key: | QNIVTMHCCGCLHV-UHFFFAOYSA-N |