N-(3-methoxyphenyl)-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-(3-methoxyphenyl)-2-{3-[(4-methylphenyl)methyl]-7-oxo-3,7-dihydro-6H-[1,2,3]triazolo[4,5-d]pyrimidin-6-yl}acetamide
N-(3-methoxyphenyl)-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: | C656-0027 |
Compound Name: | N-(3-methoxyphenyl)-2-{3-[(4-methylphenyl)methyl]-7-oxo-3,7-dihydro-6H-[1,2,3]triazolo[4,5-d]pyrimidin-6-yl}acetamide |
Molecular Weight: | 404.43 |
Molecular Formula: | C21 H20 N6 O3 |
Smiles: | Cc1ccc(Cn2c3c(C(N(CC(Nc4cccc(c4)OC)=O)C=N3)=O)nn2)cc1 |
Stereo: | ACHIRAL |
logP: | 2.2757 |
logD: | 2.2757 |
logSw: | -2.9104 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 83.715 |
InChI Key: | MZGXBSMFUPXUPJ-UHFFFAOYSA-N |