1-{5-[(4-bromo-2,6-dimethylphenoxy)methyl]-2-(4-fluorophenyl)-2-methyl-1,3,4-oxadiazol-3(2H)-yl}ethan-1-one
Chemical Structure Depiction of
1-{5-[(4-bromo-2,6-dimethylphenoxy)methyl]-2-(4-fluorophenyl)-2-methyl-1,3,4-oxadiazol-3(2H)-yl}ethan-1-one
1-{5-[(4-bromo-2,6-dimethylphenoxy)methyl]-2-(4-fluorophenyl)-2-methyl-1,3,4-oxadiazol-3(2H)-yl}ethan-1-one
Compound characteristics
| Compound ID: | G642-0397 |
| Compound Name: | 1-{5-[(4-bromo-2,6-dimethylphenoxy)methyl]-2-(4-fluorophenyl)-2-methyl-1,3,4-oxadiazol-3(2H)-yl}ethan-1-one |
| Molecular Weight: | 435.29 |
| Molecular Formula: | C20 H20 Br F N2 O3 |
| Smiles: | CC(N1C(C)(c2ccc(cc2)F)OC(COc2c(C)cc(cc2C)[Br])=N1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.4442 |
| logD: | 5.4442 |
| logSw: | -5.4243 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 42.201 |
| InChI Key: | HSHXCKTYWKYSFG-FQEVSTJZSA-N |