5-(1-{[2-(3-chlorophenyl)-5-methyl-1,3-oxazol-4-yl]methyl}-5-methyl-1H-1,2,3-triazol-4-yl)-3-[4-(methylsulfanyl)phenyl]-1,2,4-oxadiazole
Chemical Structure Depiction of
5-(1-{[2-(3-chlorophenyl)-5-methyl-1,3-oxazol-4-yl]methyl}-5-methyl-1H-1,2,3-triazol-4-yl)-3-[4-(methylsulfanyl)phenyl]-1,2,4-oxadiazole
5-(1-{[2-(3-chlorophenyl)-5-methyl-1,3-oxazol-4-yl]methyl}-5-methyl-1H-1,2,3-triazol-4-yl)-3-[4-(methylsulfanyl)phenyl]-1,2,4-oxadiazole
Compound characteristics
| Compound ID: | M007-0112 |
| Compound Name: | 5-(1-{[2-(3-chlorophenyl)-5-methyl-1,3-oxazol-4-yl]methyl}-5-methyl-1H-1,2,3-triazol-4-yl)-3-[4-(methylsulfanyl)phenyl]-1,2,4-oxadiazole |
| Molecular Weight: | 478.96 |
| Molecular Formula: | C23 H19 Cl N6 O2 S |
| Smiles: | Cc1c(c2nc(c3ccc(cc3)SC)no2)nnn1Cc1c(C)oc(c2cccc(c2)[Cl])n1 |
| Stereo: | ACHIRAL |
| logP: | 5.5304 |
| logD: | 5.5304 |
| logSw: | -6.029 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 76.473 |
| InChI Key: | ZPUFGGCQCMMTMZ-UHFFFAOYSA-N |