N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-(4-methyl-1-oxopyrrolo[1,2-d][1,2,4]triazin-2(1H)-yl)acetamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-(4-methyl-1-oxopyrrolo[1,2-d][1,2,4]triazin-2(1H)-yl)acetamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-(4-methyl-1-oxopyrrolo[1,2-d][1,2,4]triazin-2(1H)-yl)acetamide
Compound characteristics
| Compound ID: | E020-0422 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-(4-methyl-1-oxopyrrolo[1,2-d][1,2,4]triazin-2(1H)-yl)acetamide |
| Molecular Weight: | 340.34 |
| Molecular Formula: | C17 H16 N4 O4 |
| Smiles: | CC1=NN(CC(NCc2ccc3c(c2)OCO3)=O)C(c2cccn12)=O |
| Stereo: | ACHIRAL |
| logP: | 1.6226 |
| logD: | 1.6226 |
| logSw: | -2.3106 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.886 |
| InChI Key: | FSSLOEXNHHYGOP-UHFFFAOYSA-N |