N-[(2-bromophenyl)methyl]-2-(5-methyl-8-oxofuro[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-7(8H)-yl)acetamide
Chemical Structure Depiction of
N-[(2-bromophenyl)methyl]-2-(5-methyl-8-oxofuro[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-7(8H)-yl)acetamide
N-[(2-bromophenyl)methyl]-2-(5-methyl-8-oxofuro[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-7(8H)-yl)acetamide
Compound characteristics
| Compound ID: | C794-0168 |
| Compound Name: | N-[(2-bromophenyl)methyl]-2-(5-methyl-8-oxofuro[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-7(8H)-yl)acetamide |
| Molecular Weight: | 415.24 |
| Molecular Formula: | C18 H15 Br N4 O3 |
| Smiles: | CC1=NN(CC(NCc2ccccc2[Br])=O)C(c2cc3c(cco3)n12)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5433 |
| logD: | 2.5433 |
| logSw: | -2.8128 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.319 |
| InChI Key: | XJAVOGYMMNRSED-UHFFFAOYSA-N |