2-(4-bromophenyl)-4-{[2-(trifluoromethyl)phenyl]methylidene}-1,3-oxazol-5(4H)-one
Chemical Structure Depiction of
2-(4-bromophenyl)-4-{[2-(trifluoromethyl)phenyl]methylidene}-1,3-oxazol-5(4H)-one
2-(4-bromophenyl)-4-{[2-(trifluoromethyl)phenyl]methylidene}-1,3-oxazol-5(4H)-one
Compound characteristics
| Compound ID: | K076-0764 |
| Compound Name: | 2-(4-bromophenyl)-4-{[2-(trifluoromethyl)phenyl]methylidene}-1,3-oxazol-5(4H)-one |
| Molecular Weight: | 396.16 |
| Molecular Formula: | C17 H9 Br F3 N O2 |
| Smiles: | C(=C1/C(=O)OC(c2ccc(cc2)[Br])=N1)\c1ccccc1C(F)(F)F |
| Stereo: | ACHIRAL |
| logP: | 4.989 |
| logD: | 4.989 |
| logSw: | -5.028 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 30.3756 |
| InChI Key: | IJWLYJGAZBLHKD-UHFFFAOYSA-N |