ethyl 3-{2-[1-oxo-4-(thiomorpholin-4-yl)[1,2,4]triazolo[4,3-a]quinoxalin-2(1H)-yl]acetamido}benzoate
Chemical Structure Depiction of
ethyl 3-{2-[1-oxo-4-(thiomorpholin-4-yl)[1,2,4]triazolo[4,3-a]quinoxalin-2(1H)-yl]acetamido}benzoate
ethyl 3-{2-[1-oxo-4-(thiomorpholin-4-yl)[1,2,4]triazolo[4,3-a]quinoxalin-2(1H)-yl]acetamido}benzoate
Compound characteristics
| Compound ID: | F844-0382 |
| Compound Name: | ethyl 3-{2-[1-oxo-4-(thiomorpholin-4-yl)[1,2,4]triazolo[4,3-a]quinoxalin-2(1H)-yl]acetamido}benzoate |
| Molecular Weight: | 492.56 |
| Molecular Formula: | C24 H24 N6 O4 S |
| Smiles: | CCOC(c1cccc(c1)NC(CN1C(N2C(C(=Nc3ccccc23)N2CCSCC2)=N1)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3007 |
| logD: | 3.3007 |
| logSw: | -3.6266 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 85.662 |
| InChI Key: | MFYXXVKHLTVSMO-UHFFFAOYSA-N |