2-(3-bromophenyl)-4-[(3,4,5-trimethoxyphenyl)methylidene]-1,3-oxazol-5(4H)-one
Chemical Structure Depiction of
2-(3-bromophenyl)-4-[(3,4,5-trimethoxyphenyl)methylidene]-1,3-oxazol-5(4H)-one
2-(3-bromophenyl)-4-[(3,4,5-trimethoxyphenyl)methylidene]-1,3-oxazol-5(4H)-one
Compound characteristics
| Compound ID: | K076-0484 |
| Compound Name: | 2-(3-bromophenyl)-4-[(3,4,5-trimethoxyphenyl)methylidene]-1,3-oxazol-5(4H)-one |
| Molecular Weight: | 418.24 |
| Molecular Formula: | C19 H16 Br N O5 |
| Smiles: | COc1cc(\C=C2/C(=O)OC(c3cccc(c3)[Br])=N2)cc(c1OC)OC |
| Stereo: | ACHIRAL |
| logP: | 3.87 |
| logD: | 3.87 |
| logSw: | -4.1846 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 53.354 |
| InChI Key: | MDMQYYHDDVHXLT-UHFFFAOYSA-N |