ethyl 2-{2-[([1,2,4]triazolo[4,3-a]quinoxalin-4-yl)sulfanyl]acetamido}benzoate
Chemical Structure Depiction of
ethyl 2-{2-[([1,2,4]triazolo[4,3-a]quinoxalin-4-yl)sulfanyl]acetamido}benzoate
ethyl 2-{2-[([1,2,4]triazolo[4,3-a]quinoxalin-4-yl)sulfanyl]acetamido}benzoate
Compound characteristics
| Compound ID: | F989-0037 |
| Compound Name: | ethyl 2-{2-[([1,2,4]triazolo[4,3-a]quinoxalin-4-yl)sulfanyl]acetamido}benzoate |
| Molecular Weight: | 407.45 |
| Molecular Formula: | C20 H17 N5 O3 S |
| Smiles: | CCOC(c1ccccc1NC(CSc1c2nncn2c2ccccc2n1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9824 |
| logD: | 2.9659 |
| logSw: | -3.4629 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.591 |
| InChI Key: | YUXMTIGFHWNLKP-UHFFFAOYSA-N |