2-[2-(4-chlorophenyl)-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]-N-(2-ethoxyphenyl)acetamide
Chemical Structure Depiction of
2-[2-(4-chlorophenyl)-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]-N-(2-ethoxyphenyl)acetamide
2-[2-(4-chlorophenyl)-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]-N-(2-ethoxyphenyl)acetamide
Compound characteristics
Compound ID: | D458-0106 |
Compound Name: | 2-[2-(4-chlorophenyl)-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]-N-(2-ethoxyphenyl)acetamide |
Molecular Weight: | 435.91 |
Molecular Formula: | C23 H22 Cl N5 O2 |
Smiles: | CCOc1ccccc1NC(Cc1c(C)nc2nc(c3ccc(cc3)[Cl])nn2c1C)=O |
Stereo: | ACHIRAL |
logP: | 4.3843 |
logD: | 4.3839 |
logSw: | -4.6035 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 60.495 |
InChI Key: | YLJDATKHSJNWQT-UHFFFAOYSA-N |