4-({[2-(3-chlorophenyl)-5-methyl-1,3-oxazol-4-yl]methyl}sulfanyl)-1-(propan-2-yl)[1,2,4]triazolo[4,3-a]quinoxaline
Chemical Structure Depiction of
4-({[2-(3-chlorophenyl)-5-methyl-1,3-oxazol-4-yl]methyl}sulfanyl)-1-(propan-2-yl)[1,2,4]triazolo[4,3-a]quinoxaline
4-({[2-(3-chlorophenyl)-5-methyl-1,3-oxazol-4-yl]methyl}sulfanyl)-1-(propan-2-yl)[1,2,4]triazolo[4,3-a]quinoxaline
Compound characteristics
| Compound ID: | C200-9137 |
| Compound Name: | 4-({[2-(3-chlorophenyl)-5-methyl-1,3-oxazol-4-yl]methyl}sulfanyl)-1-(propan-2-yl)[1,2,4]triazolo[4,3-a]quinoxaline |
| Molecular Weight: | 449.96 |
| Molecular Formula: | C23 H20 Cl N5 O S |
| Smiles: | CC(C)c1nnc2c(nc3ccccc3n12)SCc1c(C)oc(c2cccc(c2)[Cl])n1 |
| Stereo: | ACHIRAL |
| logP: | 5.838 |
| logD: | 5.8379 |
| logSw: | -6.0669 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 47.902 |
| InChI Key: | YFBMJUKNEIBAJN-UHFFFAOYSA-N |