ethyl (5-methyl-2-{[(2-methylphenyl)methyl]amino}-7-oxo-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)acetate
Chemical Structure Depiction of
ethyl (5-methyl-2-{[(2-methylphenyl)methyl]amino}-7-oxo-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)acetate
ethyl (5-methyl-2-{[(2-methylphenyl)methyl]amino}-7-oxo-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)acetate
Compound characteristics
| Compound ID: | D298-0173 |
| Compound Name: | ethyl (5-methyl-2-{[(2-methylphenyl)methyl]amino}-7-oxo-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)acetate |
| Molecular Weight: | 355.39 |
| Molecular Formula: | C18 H21 N5 O3 |
| Smiles: | CCOC(CC1=C(C)Nc2nc(NCc3ccccc3C)nn2C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.6951 |
| logD: | 2.6759 |
| logSw: | -2.7999 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 82.051 |
| InChI Key: | FJEZFLCASQMAQH-UHFFFAOYSA-N |