ethyl 4-{2-[4-oxo-1-(propan-2-yl)[1,2,4]triazolo[4,3-a]quinoxalin-5(4H)-yl]acetamido}benzoate
Chemical Structure Depiction of
ethyl 4-{2-[4-oxo-1-(propan-2-yl)[1,2,4]triazolo[4,3-a]quinoxalin-5(4H)-yl]acetamido}benzoate
ethyl 4-{2-[4-oxo-1-(propan-2-yl)[1,2,4]triazolo[4,3-a]quinoxalin-5(4H)-yl]acetamido}benzoate
Compound characteristics
| Compound ID: | F417-0605 |
| Compound Name: | ethyl 4-{2-[4-oxo-1-(propan-2-yl)[1,2,4]triazolo[4,3-a]quinoxalin-5(4H)-yl]acetamido}benzoate |
| Molecular Weight: | 433.47 |
| Molecular Formula: | C23 H23 N5 O4 |
| Smiles: | CCOC(c1ccc(cc1)NC(CN1C(c2nnc(C(C)C)n2c2ccccc12)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2652 |
| logD: | 3.2651 |
| logSw: | -3.4747 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 83.275 |
| InChI Key: | IYFJMBSHZYCAII-UHFFFAOYSA-N |