ethyl (2-{[(4-ethylphenyl)methyl]amino}-5-methyl-7-oxo-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)acetate
Chemical Structure Depiction of
ethyl (2-{[(4-ethylphenyl)methyl]amino}-5-methyl-7-oxo-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)acetate
ethyl (2-{[(4-ethylphenyl)methyl]amino}-5-methyl-7-oxo-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)acetate
Compound characteristics
| Compound ID: | D298-0117 |
| Compound Name: | ethyl (2-{[(4-ethylphenyl)methyl]amino}-5-methyl-7-oxo-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)acetate |
| Molecular Weight: | 369.42 |
| Molecular Formula: | C19 H23 N5 O3 |
| Smiles: | CCc1ccc(CNc2nc3NC(C)=C(CC(=O)OCC)C(n3n2)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 2.7378 |
| logD: | 2.7187 |
| logSw: | -2.9293 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 82.051 |
| InChI Key: | VYZSZSCGLRZCKB-UHFFFAOYSA-N |