N-(2-chloro-4-methylphenyl)-2-{[1-(4-methylphenyl)[1,2,4]triazolo[4,3-a]quinoxalin-4-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-(2-chloro-4-methylphenyl)-2-{[1-(4-methylphenyl)[1,2,4]triazolo[4,3-a]quinoxalin-4-yl]sulfanyl}acetamide
N-(2-chloro-4-methylphenyl)-2-{[1-(4-methylphenyl)[1,2,4]triazolo[4,3-a]quinoxalin-4-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | F989-0870 |
| Compound Name: | N-(2-chloro-4-methylphenyl)-2-{[1-(4-methylphenyl)[1,2,4]triazolo[4,3-a]quinoxalin-4-yl]sulfanyl}acetamide |
| Molecular Weight: | 473.98 |
| Molecular Formula: | C25 H20 Cl N5 O S |
| Smiles: | Cc1ccc(cc1)c1nnc2c(nc3ccccc3n12)SCC(Nc1ccc(C)cc1[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 6.0082 |
| logD: | 6.008 |
| logSw: | -6.0896 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.96 |
| InChI Key: | UKKNWSLMTLQZSK-UHFFFAOYSA-N |