N-(2,5-difluorophenyl)-2-(4,5-dimethyl-7-oxo-2-phenyl-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)acetamide
Chemical Structure Depiction of
N-(2,5-difluorophenyl)-2-(4,5-dimethyl-7-oxo-2-phenyl-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)acetamide
N-(2,5-difluorophenyl)-2-(4,5-dimethyl-7-oxo-2-phenyl-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)acetamide
Compound characteristics
| Compound ID: | D584-0082 |
| Compound Name: | N-(2,5-difluorophenyl)-2-(4,5-dimethyl-7-oxo-2-phenyl-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)acetamide |
| Molecular Weight: | 409.39 |
| Molecular Formula: | C21 H17 F2 N5 O2 |
| Smiles: | [H]C([H])([H])N1C(C)=C(CC(Nc2cc(ccc2F)F)=O)C(n2c1nc(c1ccccc1)n2)=O |
| Stereo: | ACHIRAL |
| logP: | 3.264 |
| logD: | 3.2551 |
| logSw: | -3.54 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.7 |
| InChI Key: | JATOCWAJRKPSML-UHFFFAOYSA-N |