2-(benzylsulfanyl)-7-methyl-6-[2-(piperidin-1-yl)pyrimidin-4-yl][1,2,4]triazolo[1,5-a]pyrimidine
Chemical Structure Depiction of
2-(benzylsulfanyl)-7-methyl-6-[2-(piperidin-1-yl)pyrimidin-4-yl][1,2,4]triazolo[1,5-a]pyrimidine
2-(benzylsulfanyl)-7-methyl-6-[2-(piperidin-1-yl)pyrimidin-4-yl][1,2,4]triazolo[1,5-a]pyrimidine
Compound characteristics
Compound ID: | Y020-4229 |
Compound Name: | 2-(benzylsulfanyl)-7-methyl-6-[2-(piperidin-1-yl)pyrimidin-4-yl][1,2,4]triazolo[1,5-a]pyrimidine |
Molecular Weight: | 417.53 |
Molecular Formula: | C22 H23 N7 S |
Smiles: | Cc1c(cnc2nc(nn12)SCc1ccccc1)c1ccnc(n1)N1CCCCC1 |
Stereo: | ACHIRAL |
logP: | 3.904 |
logD: | 3.9037 |
logSw: | -3.9972 |
Hydrogen bond acceptors count: | 6 |
Polar surface area: | 50.882 |
InChI Key: | DWYUAOLXCBRPHJ-UHFFFAOYSA-N |