N-[(2-bromophenyl)methyl]-2-(4-methyl-1-oxopyrrolo[1,2-d][1,2,4]triazin-2(1H)-yl)acetamide
Chemical Structure Depiction of
N-[(2-bromophenyl)methyl]-2-(4-methyl-1-oxopyrrolo[1,2-d][1,2,4]triazin-2(1H)-yl)acetamide
N-[(2-bromophenyl)methyl]-2-(4-methyl-1-oxopyrrolo[1,2-d][1,2,4]triazin-2(1H)-yl)acetamide
Compound characteristics
| Compound ID: | E020-0600 |
| Compound Name: | N-[(2-bromophenyl)methyl]-2-(4-methyl-1-oxopyrrolo[1,2-d][1,2,4]triazin-2(1H)-yl)acetamide |
| Molecular Weight: | 375.22 |
| Molecular Formula: | C16 H15 Br N4 O2 |
| Smiles: | CC1=NN(CC(NCc2ccccc2[Br])=O)C(c2cccn12)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5815 |
| logD: | 2.5815 |
| logSw: | -2.7455 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.77 |
| InChI Key: | RTIBJRZLGJMSHM-UHFFFAOYSA-N |