dimethyl 5-[(8-methyl[1,2,4]triazolo[4,3-a]quinoxalin-4-yl)amino]benzene-1,3-dicarboxylate
Chemical Structure Depiction of
dimethyl 5-[(8-methyl[1,2,4]triazolo[4,3-a]quinoxalin-4-yl)amino]benzene-1,3-dicarboxylate
dimethyl 5-[(8-methyl[1,2,4]triazolo[4,3-a]quinoxalin-4-yl)amino]benzene-1,3-dicarboxylate
Compound characteristics
| Compound ID: | C735-0206 |
| Compound Name: | dimethyl 5-[(8-methyl[1,2,4]triazolo[4,3-a]quinoxalin-4-yl)amino]benzene-1,3-dicarboxylate |
| Molecular Weight: | 391.38 |
| Molecular Formula: | C20 H17 N5 O4 |
| Smiles: | Cc1ccc2c(c1)n1cnnc1c(Nc1cc(cc(c1)C(=O)OC)C(=O)OC)n2 |
| Stereo: | ACHIRAL |
| logP: | 3.7112 |
| logD: | 3.7008 |
| logSw: | -3.9926 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 82.426 |
| InChI Key: | PSMHWJMIIHSWTB-UHFFFAOYSA-N |