4-[(3-bromophenyl)methylidene]-2-[2-(3-nitrophenyl)ethenyl]-1,3-oxazol-5(4H)-one
Chemical Structure Depiction of
4-[(3-bromophenyl)methylidene]-2-[2-(3-nitrophenyl)ethenyl]-1,3-oxazol-5(4H)-one
4-[(3-bromophenyl)methylidene]-2-[2-(3-nitrophenyl)ethenyl]-1,3-oxazol-5(4H)-one
Compound characteristics
| Compound ID: | K088-0988 |
| Compound Name: | 4-[(3-bromophenyl)methylidene]-2-[2-(3-nitrophenyl)ethenyl]-1,3-oxazol-5(4H)-one |
| Molecular Weight: | 399.2 |
| Molecular Formula: | C18 H11 Br N2 O4 |
| Smiles: | C(=C\c1cccc(c1)[N+]([O-])=O)\C1=NC(=C\c2cccc(c2)[Br])\C(=O)O1 |
| Stereo: | ACHIRAL |
| logP: | 4.6714 |
| logD: | 4.6714 |
| logSw: | -4.9011 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 63.903 |
| InChI Key: | NLMMKIPBGNLSAH-UHFFFAOYSA-N |