2-(2-bromo-4-methoxyphenyl)-4-[(4-nitrophenyl)methylidene]-1,3-oxazol-5(4H)-one
Chemical Structure Depiction of
2-(2-bromo-4-methoxyphenyl)-4-[(4-nitrophenyl)methylidene]-1,3-oxazol-5(4H)-one
2-(2-bromo-4-methoxyphenyl)-4-[(4-nitrophenyl)methylidene]-1,3-oxazol-5(4H)-one
Compound characteristics
| Compound ID: | K088-2027 |
| Compound Name: | 2-(2-bromo-4-methoxyphenyl)-4-[(4-nitrophenyl)methylidene]-1,3-oxazol-5(4H)-one |
| Molecular Weight: | 403.19 |
| Molecular Formula: | C17 H11 Br N2 O5 |
| Smiles: | COc1ccc(C2=NC(=C/c3ccc(cc3)[N+]([O-])=O)\C(=O)O2)c(c1)[Br] |
| Stereo: | ACHIRAL |
| logP: | 3.9269 |
| logD: | 3.9269 |
| logSw: | -4.1944 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 71.301 |
| InChI Key: | KWNACLYDPBOKQZ-UHFFFAOYSA-N |