N-(4-methylphenyl)-2-{4-[(3-methylphenyl)sulfanyl]-1-oxo[1,2,4]triazolo[4,3-a]quinoxalin-2(1H)-yl}acetamide
Chemical Structure Depiction of
N-(4-methylphenyl)-2-{4-[(3-methylphenyl)sulfanyl]-1-oxo[1,2,4]triazolo[4,3-a]quinoxalin-2(1H)-yl}acetamide
N-(4-methylphenyl)-2-{4-[(3-methylphenyl)sulfanyl]-1-oxo[1,2,4]triazolo[4,3-a]quinoxalin-2(1H)-yl}acetamide
Compound characteristics
| Compound ID: | F843-0660 |
| Compound Name: | N-(4-methylphenyl)-2-{4-[(3-methylphenyl)sulfanyl]-1-oxo[1,2,4]triazolo[4,3-a]quinoxalin-2(1H)-yl}acetamide |
| Molecular Weight: | 455.54 |
| Molecular Formula: | C25 H21 N5 O2 S |
| Smiles: | Cc1ccc(cc1)NC(CN1C(N2C(C(=Nc3ccccc23)Sc2cccc(C)c2)=N1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.9645 |
| logD: | 4.9645 |
| logSw: | -4.6312 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.286 |
| InChI Key: | FACWBQMVFNORAH-UHFFFAOYSA-N |