N-[2-(4-chlorophenyl)ethyl]-2-(4-ethyl-1-oxopyrrolo[1,2-d][1,2,4]triazin-2(1H)-yl)acetamide
Chemical Structure Depiction of
N-[2-(4-chlorophenyl)ethyl]-2-(4-ethyl-1-oxopyrrolo[1,2-d][1,2,4]triazin-2(1H)-yl)acetamide
N-[2-(4-chlorophenyl)ethyl]-2-(4-ethyl-1-oxopyrrolo[1,2-d][1,2,4]triazin-2(1H)-yl)acetamide
Compound characteristics
| Compound ID: | E020-0701 |
| Compound Name: | N-[2-(4-chlorophenyl)ethyl]-2-(4-ethyl-1-oxopyrrolo[1,2-d][1,2,4]triazin-2(1H)-yl)acetamide |
| Molecular Weight: | 358.83 |
| Molecular Formula: | C18 H19 Cl N4 O2 |
| Smiles: | CCC1=NN(CC(NCCc2ccc(cc2)[Cl])=O)C(c2cccn12)=O |
| Stereo: | ACHIRAL |
| logP: | 2.4155 |
| logD: | 2.4155 |
| logSw: | -3.2617 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.703 |
| InChI Key: | ZUMCUMYYEMXKDZ-UHFFFAOYSA-N |