N-benzyl-2-[5,7-dimethyl-2-(3-methylphenyl)[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]-N-(2-hydroxyethyl)acetamide
Chemical Structure Depiction of
N-benzyl-2-[5,7-dimethyl-2-(3-methylphenyl)[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]-N-(2-hydroxyethyl)acetamide
N-benzyl-2-[5,7-dimethyl-2-(3-methylphenyl)[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]-N-(2-hydroxyethyl)acetamide
Compound characteristics
Compound ID: | D458-0348 |
Compound Name: | N-benzyl-2-[5,7-dimethyl-2-(3-methylphenyl)[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]-N-(2-hydroxyethyl)acetamide |
Molecular Weight: | 429.52 |
Molecular Formula: | C25 H27 N5 O2 |
Smiles: | Cc1cccc(c1)c1nc2nc(C)c(CC(N(CCO)Cc3ccccc3)=O)c(C)n2n1 |
Stereo: | ACHIRAL |
logP: | 3.4242 |
logD: | 3.4242 |
logSw: | -3.6742 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 63.422 |
InChI Key: | FNHKQYHGJKFHKT-UHFFFAOYSA-N |