N-(4-cyanophenyl)-2-[4-(3,5-dimethylphenoxy)-1-oxo[1,2,4]triazolo[4,3-a]quinoxalin-2(1H)-yl]acetamide
Chemical Structure Depiction of
N-(4-cyanophenyl)-2-[4-(3,5-dimethylphenoxy)-1-oxo[1,2,4]triazolo[4,3-a]quinoxalin-2(1H)-yl]acetamide
N-(4-cyanophenyl)-2-[4-(3,5-dimethylphenoxy)-1-oxo[1,2,4]triazolo[4,3-a]quinoxalin-2(1H)-yl]acetamide
Compound characteristics
| Compound ID: | F842-0907 |
| Compound Name: | N-(4-cyanophenyl)-2-[4-(3,5-dimethylphenoxy)-1-oxo[1,2,4]triazolo[4,3-a]quinoxalin-2(1H)-yl]acetamide |
| Molecular Weight: | 464.48 |
| Molecular Formula: | C26 H20 N6 O3 |
| Smiles: | Cc1cc(C)cc(c1)OC1C2=NN(CC(Nc3ccc(C#N)cc3)=O)C(N2c2ccccc2N=1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.13 |
| logD: | 4.13 |
| logSw: | -4.341 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 86.97 |
| InChI Key: | FJLJKWKGGXEYJQ-UHFFFAOYSA-N |