3-butyl-5-[3-(2-chlorophenyl)-5-methyl-1,2-oxazol-4-yl]-1,2,4-oxadiazole
Chemical Structure Depiction of
3-butyl-5-[3-(2-chlorophenyl)-5-methyl-1,2-oxazol-4-yl]-1,2,4-oxadiazole
3-butyl-5-[3-(2-chlorophenyl)-5-methyl-1,2-oxazol-4-yl]-1,2,4-oxadiazole
Compound characteristics
| Compound ID: | K086-0059 |
| Compound Name: | 3-butyl-5-[3-(2-chlorophenyl)-5-methyl-1,2-oxazol-4-yl]-1,2,4-oxadiazole |
| Molecular Weight: | 317.77 |
| Molecular Formula: | C16 H16 Cl N3 O2 |
| Smiles: | CCCCc1nc(c2c(c3ccccc3[Cl])noc2C)on1 |
| Stereo: | ACHIRAL |
| logP: | 4.3063 |
| logD: | 4.3063 |
| logSw: | -4.82 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 54.867 |
| InChI Key: | HMKDOXIHYYWELC-UHFFFAOYSA-N |