6-benzyl-5-methyl-2-(pyridin-3-yl)[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
Chemical Structure Depiction of
6-benzyl-5-methyl-2-(pyridin-3-yl)[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
6-benzyl-5-methyl-2-(pyridin-3-yl)[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
Compound characteristics
Compound ID: | D043-0127 |
Compound Name: | 6-benzyl-5-methyl-2-(pyridin-3-yl)[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one |
Molecular Weight: | 317.35 |
Molecular Formula: | C18 H15 N5 O |
Smiles: | CC1=C(Cc2ccccc2)C(n2c(N1)nc(c1cccnc1)n2)=O |
Stereo: | ACHIRAL |
logP: | 2.3929 |
logD: | 2.2345 |
logSw: | -2.3883 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 59.498 |
InChI Key: | SEAMIQJVHPGWDQ-UHFFFAOYSA-N |