5-[3-(2-chlorophenyl)-5-methyl-1,2-oxazol-4-yl]-3-[4-(4-propylcyclohexyl)phenyl]-1,2,4-oxadiazole
Chemical Structure Depiction of
5-[3-(2-chlorophenyl)-5-methyl-1,2-oxazol-4-yl]-3-[4-(4-propylcyclohexyl)phenyl]-1,2,4-oxadiazole
5-[3-(2-chlorophenyl)-5-methyl-1,2-oxazol-4-yl]-3-[4-(4-propylcyclohexyl)phenyl]-1,2,4-oxadiazole
Compound characteristics
Compound ID: | K086-0004 |
Compound Name: | 5-[3-(2-chlorophenyl)-5-methyl-1,2-oxazol-4-yl]-3-[4-(4-propylcyclohexyl)phenyl]-1,2,4-oxadiazole |
Molecular Weight: | 461.99 |
Molecular Formula: | C27 H28 Cl N3 O2 |
Smiles: | CCCC1CCC(CC1)c1ccc(cc1)c1nc(c2c(c3ccccc3[Cl])noc2C)on1 |
Stereo: | ACHIRAL |
logP: | 8.5801 |
logD: | 8.5801 |
logSw: | -6.8347 |
Hydrogen bond acceptors count: | 5 |
Polar surface area: | 53.525 |
InChI Key: | PNMMTKGVTLUDRN-UHFFFAOYSA-N |