1-methyl-4-{[(4-methylphenyl)methyl]sulfanyl}[1,2,4]triazolo[4,3-a]quinoxaline
Chemical Structure Depiction of
1-methyl-4-{[(4-methylphenyl)methyl]sulfanyl}[1,2,4]triazolo[4,3-a]quinoxaline
1-methyl-4-{[(4-methylphenyl)methyl]sulfanyl}[1,2,4]triazolo[4,3-a]quinoxaline
Compound characteristics
| Compound ID: | C200-9083 |
| Compound Name: | 1-methyl-4-{[(4-methylphenyl)methyl]sulfanyl}[1,2,4]triazolo[4,3-a]quinoxaline |
| Molecular Weight: | 320.41 |
| Molecular Formula: | C18 H16 N4 S |
| Smiles: | Cc1ccc(CSc2c3nnc(C)n3c3ccccc3n2)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.5725 |
| logD: | 3.5725 |
| logSw: | -3.5021 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 30.5572 |
| InChI Key: | ADMVEPMYDAETEB-UHFFFAOYSA-N |