ethyl 2-{2-[1-(4-methylphenyl)-4-oxo[1,2,4]triazolo[4,3-a]quinoxalin-5(4H)-yl]acetamido}benzoate
Chemical Structure Depiction of
ethyl 2-{2-[1-(4-methylphenyl)-4-oxo[1,2,4]triazolo[4,3-a]quinoxalin-5(4H)-yl]acetamido}benzoate
ethyl 2-{2-[1-(4-methylphenyl)-4-oxo[1,2,4]triazolo[4,3-a]quinoxalin-5(4H)-yl]acetamido}benzoate
Compound characteristics
| Compound ID: | F417-0981 |
| Compound Name: | ethyl 2-{2-[1-(4-methylphenyl)-4-oxo[1,2,4]triazolo[4,3-a]quinoxalin-5(4H)-yl]acetamido}benzoate |
| Molecular Weight: | 481.51 |
| Molecular Formula: | C27 H23 N5 O4 |
| Smiles: | CCOC(c1ccccc1NC(CN1C(c2nnc(c3ccc(C)cc3)n2c2ccccc12)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1951 |
| logD: | 4.1774 |
| logSw: | -4.2054 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 82.305 |
| InChI Key: | MJAKVTGIMDFHEE-UHFFFAOYSA-N |