7-anilino-5-methyl-2-(2-phenoxyethyl)[1,2,4]triazolo[4,3-a]pyrimidin-3(2H)-one
Chemical Structure Depiction of
7-anilino-5-methyl-2-(2-phenoxyethyl)[1,2,4]triazolo[4,3-a]pyrimidin-3(2H)-one
7-anilino-5-methyl-2-(2-phenoxyethyl)[1,2,4]triazolo[4,3-a]pyrimidin-3(2H)-one
Compound characteristics
Compound ID: | P573-7698 |
Compound Name: | 7-anilino-5-methyl-2-(2-phenoxyethyl)[1,2,4]triazolo[4,3-a]pyrimidin-3(2H)-one |
Molecular Weight: | 361.4 |
Molecular Formula: | C20 H19 N5 O2 |
Smiles: | CC1=CC(Nc2ccccc2)=NC2=NN(CCOc3ccccc3)C(N12)=O |
Stereo: | ACHIRAL |
logP: | 3.404 |
logD: | 3.4039 |
logSw: | -3.533 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 58.906 |
InChI Key: | QSVRCOPSRCGJQW-UHFFFAOYSA-N |