N-(2-ethylphenyl)-2-[7-(3-methylpiperidin-1-yl)-3-oxo[1,2,4]triazolo[4,3-a]pyrimidin-2(3H)-yl]acetamide
Chemical Structure Depiction of
N-(2-ethylphenyl)-2-[7-(3-methylpiperidin-1-yl)-3-oxo[1,2,4]triazolo[4,3-a]pyrimidin-2(3H)-yl]acetamide
N-(2-ethylphenyl)-2-[7-(3-methylpiperidin-1-yl)-3-oxo[1,2,4]triazolo[4,3-a]pyrimidin-2(3H)-yl]acetamide
Compound characteristics
Compound ID: | P573-1608 |
Compound Name: | N-(2-ethylphenyl)-2-[7-(3-methylpiperidin-1-yl)-3-oxo[1,2,4]triazolo[4,3-a]pyrimidin-2(3H)-yl]acetamide |
Molecular Weight: | 394.48 |
Molecular Formula: | C21 H26 N6 O2 |
Smiles: | CCc1ccccc1NC(CN1C(N2C=CC(=NC2=N1)N1CCCC(C)C1)=O)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 2.6376 |
logD: | 2.6376 |
logSw: | -2.8414 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 67.441 |
InChI Key: | VCLADHLLESHVTL-HNNXBMFYSA-N |