4-[(5-bromo-2-fluorophenyl)methylidene]-2-(3,4-dimethoxyphenyl)-1,3-oxazol-5(4H)-one
Chemical Structure Depiction of
4-[(5-bromo-2-fluorophenyl)methylidene]-2-(3,4-dimethoxyphenyl)-1,3-oxazol-5(4H)-one
4-[(5-bromo-2-fluorophenyl)methylidene]-2-(3,4-dimethoxyphenyl)-1,3-oxazol-5(4H)-one
Compound characteristics
| Compound ID: | 2113-0136 |
| Compound Name: | 4-[(5-bromo-2-fluorophenyl)methylidene]-2-(3,4-dimethoxyphenyl)-1,3-oxazol-5(4H)-one |
| Molecular Weight: | 406.21 |
| Molecular Formula: | C18 H13 Br F N O4 |
| Smiles: | COc1ccc(cc1OC)C1=NC(=C/c2cc(ccc2F)[Br])\C(=O)O1 |
| Stereo: | ACHIRAL |
| logP: | 3.9166 |
| logD: | 3.9166 |
| logSw: | -4.2281 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 45.636 |
| InChI Key: | MZNNSXMPDWKJTM-UHFFFAOYSA-N |