4-{[(5-methyl-2-{4-[(propan-2-yl)oxy]phenyl}-1,3-oxazol-4-yl)methyl]sulfanyl}-1-(propan-2-yl)[1,2,4]triazolo[4,3-a]quinoxaline
Chemical Structure Depiction of
4-{[(5-methyl-2-{4-[(propan-2-yl)oxy]phenyl}-1,3-oxazol-4-yl)methyl]sulfanyl}-1-(propan-2-yl)[1,2,4]triazolo[4,3-a]quinoxaline
4-{[(5-methyl-2-{4-[(propan-2-yl)oxy]phenyl}-1,3-oxazol-4-yl)methyl]sulfanyl}-1-(propan-2-yl)[1,2,4]triazolo[4,3-a]quinoxaline
Compound characteristics
| Compound ID: | C200-9086 |
| Compound Name: | 4-{[(5-methyl-2-{4-[(propan-2-yl)oxy]phenyl}-1,3-oxazol-4-yl)methyl]sulfanyl}-1-(propan-2-yl)[1,2,4]triazolo[4,3-a]quinoxaline |
| Molecular Weight: | 473.6 |
| Molecular Formula: | C26 H27 N5 O2 S |
| Smiles: | CC(C)c1nnc2c(nc3ccccc3n12)SCc1c(C)oc(c2ccc(cc2)OC(C)C)n1 |
| Stereo: | ACHIRAL |
| logP: | 5.922 |
| logD: | 5.9219 |
| logSw: | -5.6979 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 54.705 |
| InChI Key: | LGZFOMRMQUJADG-UHFFFAOYSA-N |