2-[8-(3,5-dimethylphenoxy)-3-oxo[1,2,4]triazolo[4,3-a]pyrazin-2(3H)-yl]-N-(4-methoxyphenyl)acetamide
Chemical Structure Depiction of
2-[8-(3,5-dimethylphenoxy)-3-oxo[1,2,4]triazolo[4,3-a]pyrazin-2(3H)-yl]-N-(4-methoxyphenyl)acetamide
2-[8-(3,5-dimethylphenoxy)-3-oxo[1,2,4]triazolo[4,3-a]pyrazin-2(3H)-yl]-N-(4-methoxyphenyl)acetamide
Compound characteristics
Compound ID: | M446-2063 |
Compound Name: | 2-[8-(3,5-dimethylphenoxy)-3-oxo[1,2,4]triazolo[4,3-a]pyrazin-2(3H)-yl]-N-(4-methoxyphenyl)acetamide |
Molecular Weight: | 419.44 |
Molecular Formula: | C22 H21 N5 O4 |
Smiles: | Cc1cc(C)cc(c1)OC1C2=NN(CC(Nc3ccc(cc3)OC)=O)C(N2C=CN=1)=O |
Stereo: | ACHIRAL |
logP: | 2.9563 |
logD: | 2.9563 |
logSw: | -3.4387 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 77.758 |
InChI Key: | GDGSKXRRKLFRJD-UHFFFAOYSA-N |