N-(3-acetylphenyl)-2-(4-methyl-1-oxopyrrolo[1,2-d][1,2,4]triazin-2(1H)-yl)acetamide
Chemical Structure Depiction of
N-(3-acetylphenyl)-2-(4-methyl-1-oxopyrrolo[1,2-d][1,2,4]triazin-2(1H)-yl)acetamide
N-(3-acetylphenyl)-2-(4-methyl-1-oxopyrrolo[1,2-d][1,2,4]triazin-2(1H)-yl)acetamide
Compound characteristics
| Compound ID: | E020-0449 |
| Compound Name: | N-(3-acetylphenyl)-2-(4-methyl-1-oxopyrrolo[1,2-d][1,2,4]triazin-2(1H)-yl)acetamide |
| Molecular Weight: | 324.34 |
| Molecular Formula: | C17 H16 N4 O3 |
| Smiles: | CC1=NN(CC(Nc2cccc(c2)C(C)=O)=O)C(c2cccn12)=O |
| Stereo: | ACHIRAL |
| logP: | 1.8726 |
| logD: | 1.8726 |
| logSw: | -2.5679 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.275 |
| InChI Key: | VRQQLVXLVOMMSV-UHFFFAOYSA-N |