N-(2,5-dimethoxyphenyl)-2-[1-oxo-4-(phenylsulfanyl)[1,2,4]triazolo[4,3-a]quinoxalin-2(1H)-yl]acetamide
Chemical Structure Depiction of
N-(2,5-dimethoxyphenyl)-2-[1-oxo-4-(phenylsulfanyl)[1,2,4]triazolo[4,3-a]quinoxalin-2(1H)-yl]acetamide
N-(2,5-dimethoxyphenyl)-2-[1-oxo-4-(phenylsulfanyl)[1,2,4]triazolo[4,3-a]quinoxalin-2(1H)-yl]acetamide
Compound characteristics
| Compound ID: | F843-0041 |
| Compound Name: | N-(2,5-dimethoxyphenyl)-2-[1-oxo-4-(phenylsulfanyl)[1,2,4]triazolo[4,3-a]quinoxalin-2(1H)-yl]acetamide |
| Molecular Weight: | 487.54 |
| Molecular Formula: | C25 H21 N5 O4 S |
| Smiles: | COc1ccc(c(c1)NC(CN1C(N2C(C(=Nc3ccccc23)Sc2ccccc2)=N1)=O)=O)OC |
| Stereo: | ACHIRAL |
| logP: | 3.7853 |
| logD: | 3.7851 |
| logSw: | -4.1125 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.762 |
| InChI Key: | ZFAMFRCYBWTMEF-UHFFFAOYSA-N |