4-{[(3-chlorophenyl)methyl]sulfanyl}-1-(propan-2-yl)[1,2,4]triazolo[4,3-a]quinoxaline
Chemical Structure Depiction of
4-{[(3-chlorophenyl)methyl]sulfanyl}-1-(propan-2-yl)[1,2,4]triazolo[4,3-a]quinoxaline
4-{[(3-chlorophenyl)methyl]sulfanyl}-1-(propan-2-yl)[1,2,4]triazolo[4,3-a]quinoxaline
Compound characteristics
| Compound ID: | C200-9072 |
| Compound Name: | 4-{[(3-chlorophenyl)methyl]sulfanyl}-1-(propan-2-yl)[1,2,4]triazolo[4,3-a]quinoxaline |
| Molecular Weight: | 368.89 |
| Molecular Formula: | C19 H17 Cl N4 S |
| Smiles: | CC(C)c1nnc2c(nc3ccccc3n12)SCc1cccc(c1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 5.2788 |
| logD: | 5.2788 |
| logSw: | -5.8291 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 29.7802 |
| InChI Key: | YVVDBWLNGKOYMP-UHFFFAOYSA-N |