N-(2-ethoxyphenyl)-2-{3-[(4-fluorophenyl)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-fluorophenyl)methyl]-7-oxo-3,7-dihydro-6H-[1,2,3]triazolo[4,5-d]pyrimidin-6-yl}acetamide
N-(2-ethoxyphenyl)-2-{3-[(4-fluorophenyl)methyl]-7-oxo-3,7-dihydro-6H-[1,2,3]triazolo[4,5-d]pyrimidin-6-yl}acetamide
Compound characteristics
Compound ID: | C656-0114 |
Compound Name: | N-(2-ethoxyphenyl)-2-{3-[(4-fluorophenyl)methyl]-7-oxo-3,7-dihydro-6H-[1,2,3]triazolo[4,5-d]pyrimidin-6-yl}acetamide |
Molecular Weight: | 422.42 |
Molecular Formula: | C21 H19 F N6 O3 |
Smiles: | CCOc1ccccc1NC(CN1C=Nc2c(C1=O)nnn2Cc1ccc(cc1)F)=O |
Stereo: | ACHIRAL |
logP: | 1.9896 |
logD: | 1.9896 |
logSw: | -2.5483 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 82.684 |
InChI Key: | RVOXLYVSVOVFMB-UHFFFAOYSA-N |