methyl 4-[(8-benzoyl-1-methyl[1,2,4]triazolo[4,3-a]quinoxalin-4-yl)amino]benzoate
Chemical Structure Depiction of
methyl 4-[(8-benzoyl-1-methyl[1,2,4]triazolo[4,3-a]quinoxalin-4-yl)amino]benzoate
methyl 4-[(8-benzoyl-1-methyl[1,2,4]triazolo[4,3-a]quinoxalin-4-yl)amino]benzoate
Compound characteristics
| Compound ID: | E881-0177 |
| Compound Name: | methyl 4-[(8-benzoyl-1-methyl[1,2,4]triazolo[4,3-a]quinoxalin-4-yl)amino]benzoate |
| Molecular Weight: | 437.46 |
| Molecular Formula: | C25 H19 N5 O3 |
| Smiles: | Cc1nnc2c(Nc3ccc(cc3)C(=O)OC)nc3ccc(cc3n12)C(c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2741 |
| logD: | 4.2741 |
| logSw: | -4.4079 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.89 |
| InChI Key: | UVHSZUPHFRAGER-UHFFFAOYSA-N |