2-{4-[(3-methoxyphenyl)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-methoxyphenyl)sulfanyl]-1-oxo[1,2,4]triazolo[4,3-a]quinoxalin-2(1H)-yl}-N-(2,4,6-trimethylphenyl)acetamide
2-{4-[(3-methoxyphenyl)sulfanyl]-1-oxo[1,2,4]triazolo[4,3-a]quinoxalin-2(1H)-yl}-N-(2,4,6-trimethylphenyl)acetamide
Compound characteristics
| Compound ID: | F843-0605 |
| Compound Name: | 2-{4-[(3-methoxyphenyl)sulfanyl]-1-oxo[1,2,4]triazolo[4,3-a]quinoxalin-2(1H)-yl}-N-(2,4,6-trimethylphenyl)acetamide |
| Molecular Weight: | 499.59 |
| Molecular Formula: | C27 H25 N5 O3 S |
| Smiles: | Cc1cc(C)c(c(C)c1)NC(CN1C(N2C(C(=Nc3ccccc23)Sc2cccc(c2)OC)=N1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6092 |
| logD: | 4.6092 |
| logSw: | -4.3643 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.434 |
| InChI Key: | VXLBICMQOKEIKD-UHFFFAOYSA-N |