N-(4-cyanophenyl)-2-[4-oxo-1-(propan-2-yl)[1,2,4]triazolo[4,3-a]quinoxalin-5(4H)-yl]acetamide
Chemical Structure Depiction of
N-(4-cyanophenyl)-2-[4-oxo-1-(propan-2-yl)[1,2,4]triazolo[4,3-a]quinoxalin-5(4H)-yl]acetamide
N-(4-cyanophenyl)-2-[4-oxo-1-(propan-2-yl)[1,2,4]triazolo[4,3-a]quinoxalin-5(4H)-yl]acetamide
Compound characteristics
| Compound ID: | F417-0599 |
| Compound Name: | N-(4-cyanophenyl)-2-[4-oxo-1-(propan-2-yl)[1,2,4]triazolo[4,3-a]quinoxalin-5(4H)-yl]acetamide |
| Molecular Weight: | 386.41 |
| Molecular Formula: | C21 H18 N6 O2 |
| Smiles: | CC(C)c1nnc2C(N(CC(Nc3ccc(C#N)cc3)=O)c3ccccc3n12)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3183 |
| logD: | 2.3179 |
| logSw: | -2.8946 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.577 |
| InChI Key: | GBHYVBKPIYLRHO-UHFFFAOYSA-N |