2-[6-benzyl-5-methyl-2-(4-methylphenyl)-7-oxo[1,2,4]triazolo[1,5-a]pyrimidin-4(7H)-yl]-N-(4-fluorophenyl)acetamide
Chemical Structure Depiction of
2-[6-benzyl-5-methyl-2-(4-methylphenyl)-7-oxo[1,2,4]triazolo[1,5-a]pyrimidin-4(7H)-yl]-N-(4-fluorophenyl)acetamide
2-[6-benzyl-5-methyl-2-(4-methylphenyl)-7-oxo[1,2,4]triazolo[1,5-a]pyrimidin-4(7H)-yl]-N-(4-fluorophenyl)acetamide
Compound characteristics
| Compound ID: | D584-4220 |
| Compound Name: | 2-[6-benzyl-5-methyl-2-(4-methylphenyl)-7-oxo[1,2,4]triazolo[1,5-a]pyrimidin-4(7H)-yl]-N-(4-fluorophenyl)acetamide |
| Molecular Weight: | 481.53 |
| Molecular Formula: | C28 H24 F N5 O2 |
| Smiles: | [H]C([H])(C1=C(C)N(CC(Nc2ccc(cc2)F)=O)c2nc(c3ccc(C)cc3)nn2C1=O)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 5.5869 |
| logD: | 5.5867 |
| logSw: | -5.4569 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.36 |
| InChI Key: | CCYTZIBZNPIOBJ-UHFFFAOYSA-N |