2-[5,7-dimethyl-2-(4-methylphenyl)[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-(4-methylphenyl)[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]-1-(pyrrolidin-1-yl)ethan-1-one
2-[5,7-dimethyl-2-(4-methylphenyl)[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]-1-(pyrrolidin-1-yl)ethan-1-one
Compound characteristics
Compound ID: | D458-0120 |
Compound Name: | 2-[5,7-dimethyl-2-(4-methylphenyl)[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]-1-(pyrrolidin-1-yl)ethan-1-one |
Molecular Weight: | 349.43 |
Molecular Formula: | C20 H23 N5 O |
Smiles: | Cc1ccc(cc1)c1nc2nc(C)c(CC(N3CCCC3)=O)c(C)n2n1 |
Stereo: | ACHIRAL |
logP: | 3.1451 |
logD: | 3.1451 |
logSw: | -3.0637 |
Hydrogen bond acceptors count: | 5 |
Polar surface area: | 47.591 |
InChI Key: | RPQQWWZINMHZQT-UHFFFAOYSA-N |