5-{5-methyl-1-[(5-methyl-2-phenyl-1,3-oxazol-4-yl)methyl]-1H-1,2,3-triazol-4-yl}-3-[4-(methylsulfanyl)phenyl]-1,2,4-oxadiazole
Chemical Structure Depiction of
5-{5-methyl-1-[(5-methyl-2-phenyl-1,3-oxazol-4-yl)methyl]-1H-1,2,3-triazol-4-yl}-3-[4-(methylsulfanyl)phenyl]-1,2,4-oxadiazole
5-{5-methyl-1-[(5-methyl-2-phenyl-1,3-oxazol-4-yl)methyl]-1H-1,2,3-triazol-4-yl}-3-[4-(methylsulfanyl)phenyl]-1,2,4-oxadiazole
Compound characteristics
| Compound ID: | M007-0017 |
| Compound Name: | 5-{5-methyl-1-[(5-methyl-2-phenyl-1,3-oxazol-4-yl)methyl]-1H-1,2,3-triazol-4-yl}-3-[4-(methylsulfanyl)phenyl]-1,2,4-oxadiazole |
| Molecular Weight: | 444.51 |
| Molecular Formula: | C23 H20 N6 O2 S |
| Smiles: | Cc1c(c2nc(c3ccc(cc3)SC)no2)nnn1Cc1c(C)oc(c2ccccc2)n1 |
| Stereo: | ACHIRAL |
| logP: | 4.8428 |
| logD: | 4.8428 |
| logSw: | -4.6875 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 76.473 |
| InChI Key: | AMUKABOQAPYBDT-UHFFFAOYSA-N |