N-(2,4-dimethoxyphenyl)-2-[(1-ethyl[1,2,4]triazolo[4,3-a]quinoxalin-4-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N-(2,4-dimethoxyphenyl)-2-[(1-ethyl[1,2,4]triazolo[4,3-a]quinoxalin-4-yl)sulfanyl]acetamide
N-(2,4-dimethoxyphenyl)-2-[(1-ethyl[1,2,4]triazolo[4,3-a]quinoxalin-4-yl)sulfanyl]acetamide
Compound characteristics
| Compound ID: | F989-0274 |
| Compound Name: | N-(2,4-dimethoxyphenyl)-2-[(1-ethyl[1,2,4]triazolo[4,3-a]quinoxalin-4-yl)sulfanyl]acetamide |
| Molecular Weight: | 423.49 |
| Molecular Formula: | C21 H21 N5 O3 S |
| Smiles: | CCc1nnc2c(nc3ccccc3n12)SCC(Nc1ccc(cc1OC)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2 |
| logD: | 3.1998 |
| logSw: | -3.4209 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.382 |
| InChI Key: | IBPKKNSERHPJQR-UHFFFAOYSA-N |