2-[5,7-dimethyl-2-(thiophen-2-yl)[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]-1-(pyrrolidin-1-yl)ethan-1-one
Chemical Structure Depiction of
2-[5,7-dimethyl-2-(thiophen-2-yl)[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]-1-(pyrrolidin-1-yl)ethan-1-one
2-[5,7-dimethyl-2-(thiophen-2-yl)[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]-1-(pyrrolidin-1-yl)ethan-1-one
Compound characteristics
Compound ID: | D458-0498 |
Compound Name: | 2-[5,7-dimethyl-2-(thiophen-2-yl)[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]-1-(pyrrolidin-1-yl)ethan-1-one |
Molecular Weight: | 341.43 |
Molecular Formula: | C17 H19 N5 O S |
Smiles: | Cc1c(CC(N2CCCC2)=O)c(C)n2c(n1)nc(c1cccs1)n2 |
Stereo: | ACHIRAL |
logP: | 2.4421 |
logD: | 2.4421 |
logSw: | -2.5197 |
Hydrogen bond acceptors count: | 5 |
Polar surface area: | 48.61 |
InChI Key: | LVRZXXIDSQQUTD-UHFFFAOYSA-N |