4-[(5-bromo-2-methoxyphenyl)methylidene]-2-[2-(3-nitrophenyl)ethenyl]-1,3-oxazol-5(4H)-one
Chemical Structure Depiction of
4-[(5-bromo-2-methoxyphenyl)methylidene]-2-[2-(3-nitrophenyl)ethenyl]-1,3-oxazol-5(4H)-one
4-[(5-bromo-2-methoxyphenyl)methylidene]-2-[2-(3-nitrophenyl)ethenyl]-1,3-oxazol-5(4H)-one
Compound characteristics
| Compound ID: | K088-1004 |
| Compound Name: | 4-[(5-bromo-2-methoxyphenyl)methylidene]-2-[2-(3-nitrophenyl)ethenyl]-1,3-oxazol-5(4H)-one |
| Molecular Weight: | 429.22 |
| Molecular Formula: | C19 H13 Br N2 O5 |
| Smiles: | COc1ccc(cc1\C=C1/C(=O)OC(/C=C\c2cccc(c2)[N+]([O-])=O)=N1)[Br] |
| Stereo: | ACHIRAL |
| logP: | 4.8081 |
| logD: | 4.8081 |
| logSw: | -4.8714 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 71.534 |
| InChI Key: | XNLNIQRMEBPGFV-UHFFFAOYSA-N |