ethyl 4-{2-[(1-phenyl[1,2,4]triazolo[4,3-a]quinoxalin-4-yl)sulfanyl]acetamido}benzoate
Chemical Structure Depiction of
ethyl 4-{2-[(1-phenyl[1,2,4]triazolo[4,3-a]quinoxalin-4-yl)sulfanyl]acetamido}benzoate
ethyl 4-{2-[(1-phenyl[1,2,4]triazolo[4,3-a]quinoxalin-4-yl)sulfanyl]acetamido}benzoate
Compound characteristics
| Compound ID: | F989-0722 |
| Compound Name: | ethyl 4-{2-[(1-phenyl[1,2,4]triazolo[4,3-a]quinoxalin-4-yl)sulfanyl]acetamido}benzoate |
| Molecular Weight: | 483.55 |
| Molecular Formula: | C26 H21 N5 O3 S |
| Smiles: | CCOC(c1ccc(cc1)NC(CSc1c2nnc(c3ccccc3)n2c2ccccc2n1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.3573 |
| logD: | 5.3572 |
| logSw: | -5.39 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.412 |
| InChI Key: | RPRMUCQLVMDIOQ-UHFFFAOYSA-N |