N-(4-acetylphenyl)-2-[5-methyl-3-oxo-7-(pyridin-4-yl)[1,2,4]triazolo[4,3-c]pyrimidin-2(3H)-yl]acetamide
Chemical Structure Depiction of
N-(4-acetylphenyl)-2-[5-methyl-3-oxo-7-(pyridin-4-yl)[1,2,4]triazolo[4,3-c]pyrimidin-2(3H)-yl]acetamide
N-(4-acetylphenyl)-2-[5-methyl-3-oxo-7-(pyridin-4-yl)[1,2,4]triazolo[4,3-c]pyrimidin-2(3H)-yl]acetamide
Compound characteristics
| Compound ID: | P032-2306 |
| Compound Name: | N-(4-acetylphenyl)-2-[5-methyl-3-oxo-7-(pyridin-4-yl)[1,2,4]triazolo[4,3-c]pyrimidin-2(3H)-yl]acetamide |
| Molecular Weight: | 402.41 |
| Molecular Formula: | C21 H18 N6 O3 |
| Smiles: | CC1=NC(=CC2=NN(CC(Nc3ccc(cc3)C(C)=O)=O)C(N12)=O)c1ccncc1 |
| Stereo: | ACHIRAL |
| logP: | 1.332 |
| logD: | 1.3133 |
| logSw: | -1.6658 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 87.394 |
| InChI Key: | BLADACIORNUGLF-UHFFFAOYSA-N |