2-{4-[(3-methylphenyl)sulfanyl]-1-oxo[1,2,4]triazolo[4,3-a]quinoxalin-2(1H)-yl}-N-(2,4,6-trimethylphenyl)acetamide
Chemical Structure Depiction of
2-{4-[(3-methylphenyl)sulfanyl]-1-oxo[1,2,4]triazolo[4,3-a]quinoxalin-2(1H)-yl}-N-(2,4,6-trimethylphenyl)acetamide
2-{4-[(3-methylphenyl)sulfanyl]-1-oxo[1,2,4]triazolo[4,3-a]quinoxalin-2(1H)-yl}-N-(2,4,6-trimethylphenyl)acetamide
Compound characteristics
| Compound ID: | F843-0701 |
| Compound Name: | 2-{4-[(3-methylphenyl)sulfanyl]-1-oxo[1,2,4]triazolo[4,3-a]quinoxalin-2(1H)-yl}-N-(2,4,6-trimethylphenyl)acetamide |
| Molecular Weight: | 483.59 |
| Molecular Formula: | C27 H25 N5 O2 S |
| Smiles: | Cc1cccc(c1)SC1C2=NN(CC(Nc3c(C)cc(C)cc3C)=O)C(N2c2ccccc2N=1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.0544 |
| logD: | 5.0544 |
| logSw: | -4.6269 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.89 |
| InChI Key: | RPMKTXDNJOUQAC-UHFFFAOYSA-N |