4-[(3-bromo-4-ethoxy-5-methoxyphenyl)methylidene]-2-(2-phenylethenyl)-1,3-oxazol-5(4H)-one
Chemical Structure Depiction of
4-[(3-bromo-4-ethoxy-5-methoxyphenyl)methylidene]-2-(2-phenylethenyl)-1,3-oxazol-5(4H)-one
4-[(3-bromo-4-ethoxy-5-methoxyphenyl)methylidene]-2-(2-phenylethenyl)-1,3-oxazol-5(4H)-one
Compound characteristics
Compound ID: | 3172-1080 |
Compound Name: | 4-[(3-bromo-4-ethoxy-5-methoxyphenyl)methylidene]-2-(2-phenylethenyl)-1,3-oxazol-5(4H)-one |
Molecular Weight: | 428.28 |
Molecular Formula: | C21 H18 Br N O4 |
Smiles: | CCOc1c(cc(\C=C2/C(=O)OC(/C=C/c3ccccc3)=N2)cc1[Br])OC |
Stereo: | ACHIRAL |
logP: | 4.9566 |
logD: | 4.9566 |
logSw: | -4.6722 |
Hydrogen bond acceptors count: | 6 |
Polar surface area: | 45.449 |
InChI Key: | AOHNSEAYCVWKQG-UHFFFAOYSA-N |