N-(4-acetamidophenyl)-2-{[1-(propan-2-yl)[1,2,4]triazolo[4,3-a]quinoxalin-4-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-(4-acetamidophenyl)-2-{[1-(propan-2-yl)[1,2,4]triazolo[4,3-a]quinoxalin-4-yl]sulfanyl}acetamide
N-(4-acetamidophenyl)-2-{[1-(propan-2-yl)[1,2,4]triazolo[4,3-a]quinoxalin-4-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | F989-0538 |
| Compound Name: | N-(4-acetamidophenyl)-2-{[1-(propan-2-yl)[1,2,4]triazolo[4,3-a]quinoxalin-4-yl]sulfanyl}acetamide |
| Molecular Weight: | 434.52 |
| Molecular Formula: | C22 H22 N6 O2 S |
| Smiles: | CC(C)c1nnc2c(nc3ccccc3n12)SCC(Nc1ccc(cc1)NC(C)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2225 |
| logD: | 3.2225 |
| logSw: | -3.4675 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 76.191 |
| InChI Key: | BICMFACOVQNHJN-UHFFFAOYSA-N |