methyl 4-[(1-ethyl[1,2,4]triazolo[4,3-a]quinoxalin-4-yl)amino]benzoate
Chemical Structure Depiction of
methyl 4-[(1-ethyl[1,2,4]triazolo[4,3-a]quinoxalin-4-yl)amino]benzoate
methyl 4-[(1-ethyl[1,2,4]triazolo[4,3-a]quinoxalin-4-yl)amino]benzoate
Compound characteristics
| Compound ID: | E869-0158 |
| Compound Name: | methyl 4-[(1-ethyl[1,2,4]triazolo[4,3-a]quinoxalin-4-yl)amino]benzoate |
| Molecular Weight: | 347.37 |
| Molecular Formula: | C19 H17 N5 O2 |
| Smiles: | CCc1nnc2c(Nc3ccc(cc3)C(=O)OC)nc3ccccc3n12 |
| Stereo: | ACHIRAL |
| logP: | 3.5723 |
| logD: | 3.5622 |
| logSw: | -3.5854 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.623 |
| InChI Key: | RXKYGODTHPQJQU-UHFFFAOYSA-N |