N-(2-ethoxyphenyl)-2-{3-[(4-methylphenyl)methyl]-7-oxo-3,7-dihydro-6H-[1,2,3]triazolo[4,5-d]pyrimidin-6-yl}acetamide
Chemical Structure Depiction of
N-(2-ethoxyphenyl)-2-{3-[(4-methylphenyl)methyl]-7-oxo-3,7-dihydro-6H-[1,2,3]triazolo[4,5-d]pyrimidin-6-yl}acetamide
N-(2-ethoxyphenyl)-2-{3-[(4-methylphenyl)methyl]-7-oxo-3,7-dihydro-6H-[1,2,3]triazolo[4,5-d]pyrimidin-6-yl}acetamide
Compound characteristics
| Compound ID: | C656-0029 |
| Compound Name: | N-(2-ethoxyphenyl)-2-{3-[(4-methylphenyl)methyl]-7-oxo-3,7-dihydro-6H-[1,2,3]triazolo[4,5-d]pyrimidin-6-yl}acetamide |
| Molecular Weight: | 418.45 |
| Molecular Formula: | C22 H22 N6 O3 |
| Smiles: | CCOc1ccccc1NC(CN1C=Nc2c(C1=O)nnn2Cc1ccc(C)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3839 |
| logD: | 2.3839 |
| logSw: | -2.7645 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 82.684 |
| InChI Key: | JUMXGOOSSLJRJN-UHFFFAOYSA-N |