N-[(5-bromo-2-methoxyphenyl)methyl]-2-(4-methyl-1-oxopyrrolo[1,2-d][1,2,4]triazin-2(1H)-yl)acetamide
Chemical Structure Depiction of
N-[(5-bromo-2-methoxyphenyl)methyl]-2-(4-methyl-1-oxopyrrolo[1,2-d][1,2,4]triazin-2(1H)-yl)acetamide
N-[(5-bromo-2-methoxyphenyl)methyl]-2-(4-methyl-1-oxopyrrolo[1,2-d][1,2,4]triazin-2(1H)-yl)acetamide
Compound characteristics
| Compound ID: | E020-0607 |
| Compound Name: | N-[(5-bromo-2-methoxyphenyl)methyl]-2-(4-methyl-1-oxopyrrolo[1,2-d][1,2,4]triazin-2(1H)-yl)acetamide |
| Molecular Weight: | 405.25 |
| Molecular Formula: | C17 H17 Br N4 O3 |
| Smiles: | CC1=NN(CC(NCc2cc(ccc2OC)[Br])=O)C(c2cccn12)=O |
| Stereo: | ACHIRAL |
| logP: | 2.6028 |
| logD: | 2.6028 |
| logSw: | -2.8617 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.401 |
| InChI Key: | OJZPUYCINBYZER-UHFFFAOYSA-N |