2-[3-oxo-8-(piperidin-1-yl)[1,3]thiazolo[5,4-e][1,2,4]triazolo[4,3-c]pyrimidin-2(3H)-yl]-N-(2,4,6-trimethylphenyl)acetamide
Chemical Structure Depiction of
2-[3-oxo-8-(piperidin-1-yl)[1,3]thiazolo[5,4-e][1,2,4]triazolo[4,3-c]pyrimidin-2(3H)-yl]-N-(2,4,6-trimethylphenyl)acetamide
2-[3-oxo-8-(piperidin-1-yl)[1,3]thiazolo[5,4-e][1,2,4]triazolo[4,3-c]pyrimidin-2(3H)-yl]-N-(2,4,6-trimethylphenyl)acetamide
Compound characteristics
Compound ID: | M447-0481 |
Compound Name: | 2-[3-oxo-8-(piperidin-1-yl)[1,3]thiazolo[5,4-e][1,2,4]triazolo[4,3-c]pyrimidin-2(3H)-yl]-N-(2,4,6-trimethylphenyl)acetamide |
Molecular Weight: | 451.55 |
Molecular Formula: | C22 H25 N7 O2 S |
Smiles: | Cc1cc(C)c(c(C)c1)NC(CN1C(N2C=Nc3c(C2=N1)sc(n3)N1CCCCC1)=O)=O |
Stereo: | ACHIRAL |
logP: | 3.6776 |
logD: | 3.6761 |
logSw: | -3.6731 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 77.29 |
InChI Key: | XQDSRJSNRVLODM-UHFFFAOYSA-N |