methyl (7-oxo-2-phenyl-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-5-yl)acetate
Chemical Structure Depiction of
methyl (7-oxo-2-phenyl-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-5-yl)acetate
methyl (7-oxo-2-phenyl-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-5-yl)acetate
Compound characteristics
Compound ID: | Y020-2494 |
Compound Name: | methyl (7-oxo-2-phenyl-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-5-yl)acetate |
Molecular Weight: | 284.27 |
Molecular Formula: | C14 H12 N4 O3 |
Smiles: | COC(CC1=CC(n2c(N1)nc(c1ccccc1)n2)=O)=O |
Stereo: | ACHIRAL |
logP: | 1.4348 |
logD: | 1.1586 |
logSw: | -1.9302 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 71.919 |
InChI Key: | UOZGPSVDMOZGJQ-UHFFFAOYSA-N |