2-(4,5-dimethyl-7-oxo-2-phenyl-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)-N-(3-methoxyphenyl)acetamide
Chemical Structure Depiction of
2-(4,5-dimethyl-7-oxo-2-phenyl-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)-N-(3-methoxyphenyl)acetamide
2-(4,5-dimethyl-7-oxo-2-phenyl-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)-N-(3-methoxyphenyl)acetamide
Compound characteristics
| Compound ID: | D584-0034 |
| Compound Name: | 2-(4,5-dimethyl-7-oxo-2-phenyl-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)-N-(3-methoxyphenyl)acetamide |
| Molecular Weight: | 403.44 |
| Molecular Formula: | C22 H21 N5 O3 |
| Smiles: | [H]C([H])([H])N1C(C)=C(CC(Nc2cccc(c2)OC)=O)C(n2c1nc(c1ccccc1)n2)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1631 |
| logD: | 3.1631 |
| logSw: | -3.4391 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.941 |
| InChI Key: | LEDNSXHTQWNKKE-UHFFFAOYSA-N |