2-(4-butoxyphenyl)-4-[(2,4-dibromoanilino)methylidene]-1,3-oxazol-5(4H)-one
Chemical Structure Depiction of
2-(4-butoxyphenyl)-4-[(2,4-dibromoanilino)methylidene]-1,3-oxazol-5(4H)-one
2-(4-butoxyphenyl)-4-[(2,4-dibromoanilino)methylidene]-1,3-oxazol-5(4H)-one
Compound characteristics
| Compound ID: | K091-0999 |
| Compound Name: | 2-(4-butoxyphenyl)-4-[(2,4-dibromoanilino)methylidene]-1,3-oxazol-5(4H)-one |
| Molecular Weight: | 494.18 |
| Molecular Formula: | C20 H18 Br2 N2 O3 |
| Smiles: | CCCCOc1ccc(cc1)C1=NC(=C/Nc2ccc(cc2[Br])[Br])\C(=O)O1 |
| Stereo: | ACHIRAL |
| logP: | 5.776 |
| logD: | 5.7639 |
| logSw: | -5.3808 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.696 |
| InChI Key: | SOHWKVYMVIILDV-UHFFFAOYSA-N |