3-{[2-(4-bromophenyl)-5-oxo-1,3-oxazol-4(5H)-ylidene]methyl}phenyl acetate
Chemical Structure Depiction of
3-{[2-(4-bromophenyl)-5-oxo-1,3-oxazol-4(5H)-ylidene]methyl}phenyl acetate
3-{[2-(4-bromophenyl)-5-oxo-1,3-oxazol-4(5H)-ylidene]methyl}phenyl acetate
Compound characteristics
| Compound ID: | K076-0656 |
| Compound Name: | 3-{[2-(4-bromophenyl)-5-oxo-1,3-oxazol-4(5H)-ylidene]methyl}phenyl acetate |
| Molecular Weight: | 386.2 |
| Molecular Formula: | C18 H12 Br N O4 |
| Smiles: | CC(=O)Oc1cccc(/C=C2/C(=O)OC(c3ccc(cc3)[Br])=N2)c1 |
| Stereo: | ACHIRAL |
| logP: | 3.4997 |
| logD: | 3.4997 |
| logSw: | -3.7073 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 51.127 |
| InChI Key: | SCMAUEOQZSSKCF-UHFFFAOYSA-N |