ethyl [7-oxo-2-({[4-(propan-2-yl)phenyl]methyl}amino)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-5-yl]acetate
Chemical Structure Depiction of
ethyl [7-oxo-2-({[4-(propan-2-yl)phenyl]methyl}amino)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-5-yl]acetate
ethyl [7-oxo-2-({[4-(propan-2-yl)phenyl]methyl}amino)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-5-yl]acetate
Compound characteristics
| Compound ID: | D298-0019 |
| Compound Name: | ethyl [7-oxo-2-({[4-(propan-2-yl)phenyl]methyl}amino)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-5-yl]acetate |
| Molecular Weight: | 369.42 |
| Molecular Formula: | C19 H23 N5 O3 |
| Smiles: | CCOC(CC1=CC(n2c(N1)nc(NCc1ccc(cc1)C(C)C)n2)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7482 |
| logD: | 2.37 |
| logSw: | -3.1478 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 83.14 |
| InChI Key: | APAGMZFQKNZZBL-UHFFFAOYSA-N |