5,6-dimethyl-2-{[3-(trifluoromethyl)anilino]methyl}[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
Chemical Structure Depiction of
5,6-dimethyl-2-{[3-(trifluoromethyl)anilino]methyl}[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
5,6-dimethyl-2-{[3-(trifluoromethyl)anilino]methyl}[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
Compound characteristics
| Compound ID: | D433-1315 |
| Compound Name: | 5,6-dimethyl-2-{[3-(trifluoromethyl)anilino]methyl}[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one |
| Molecular Weight: | 337.3 |
| Molecular Formula: | C15 H14 F3 N5 O |
| Smiles: | CC1=C(C)Nc2nc(CNc3cccc(c3)C(F)(F)F)nn2C1=O |
| Stereo: | ACHIRAL |
| logP: | 2.808 |
| logD: | 0.7743 |
| logSw: | -3.3391 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 61.748 |
| InChI Key: | QHXCAPGFHDJWKZ-UHFFFAOYSA-N |