5-[3-(2-chlorophenyl)-5-methyl-1,2-oxazol-4-yl]-3-[4'-(heptyloxy)[1,1'-biphenyl]-4-yl]-1,2,4-oxadiazole
Chemical Structure Depiction of
5-[3-(2-chlorophenyl)-5-methyl-1,2-oxazol-4-yl]-3-[4'-(heptyloxy)[1,1'-biphenyl]-4-yl]-1,2,4-oxadiazole
5-[3-(2-chlorophenyl)-5-methyl-1,2-oxazol-4-yl]-3-[4'-(heptyloxy)[1,1'-biphenyl]-4-yl]-1,2,4-oxadiazole
Compound characteristics
Compound ID: | K086-0009 |
Compound Name: | 5-[3-(2-chlorophenyl)-5-methyl-1,2-oxazol-4-yl]-3-[4'-(heptyloxy)[1,1'-biphenyl]-4-yl]-1,2,4-oxadiazole |
Molecular Weight: | 528.05 |
Molecular Formula: | C31 H30 Cl N3 O3 |
Smiles: | CCCCCCCOc1ccc(cc1)c1ccc(cc1)c1nc(c2c(c3ccccc3[Cl])noc2C)on1 |
Stereo: | ACHIRAL |
logP: | 9.6203 |
logD: | 9.6203 |
logSw: | -6.8212 |
Hydrogen bond acceptors count: | 6 |
Polar surface area: | 60.751 |
InChI Key: | RZBJNYBPCNVSMK-UHFFFAOYSA-N |