5-(anilinomethyl)-2-(2-methylphenyl)[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
Chemical Structure Depiction of
5-(anilinomethyl)-2-(2-methylphenyl)[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
5-(anilinomethyl)-2-(2-methylphenyl)[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
Compound characteristics
Compound ID: | D351-0404 |
Compound Name: | 5-(anilinomethyl)-2-(2-methylphenyl)[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one |
Molecular Weight: | 331.38 |
Molecular Formula: | C19 H17 N5 O |
Smiles: | Cc1ccccc1c1nc2NC(CNc3ccccc3)=CC(n2n1)=O |
Stereo: | ACHIRAL |
logP: | 3.1617 |
logD: | 3.1148 |
logSw: | -3.5377 |
Hydrogen bond acceptors count: | 4 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 61.575 |
InChI Key: | IGPSEHOQIQIPLA-UHFFFAOYSA-N |