4-[(4-chlorophenyl)methylidene]-2-[2-(3-nitrophenyl)ethenyl]-1,3-oxazol-5(4H)-one
Chemical Structure Depiction of
4-[(4-chlorophenyl)methylidene]-2-[2-(3-nitrophenyl)ethenyl]-1,3-oxazol-5(4H)-one
4-[(4-chlorophenyl)methylidene]-2-[2-(3-nitrophenyl)ethenyl]-1,3-oxazol-5(4H)-one
Compound characteristics
| Compound ID: | K088-0987 |
| Compound Name: | 4-[(4-chlorophenyl)methylidene]-2-[2-(3-nitrophenyl)ethenyl]-1,3-oxazol-5(4H)-one |
| Molecular Weight: | 354.75 |
| Molecular Formula: | C18 H11 Cl N2 O4 |
| Smiles: | C(=C\c1cccc(c1)[N+]([O-])=O)\C1=NC(=C\c2ccc(cc2)[Cl])\C(=O)O1 |
| Stereo: | ACHIRAL |
| logP: | 4.4839 |
| logD: | 4.4839 |
| logSw: | -5.0873 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 63.903 |
| InChI Key: | ABSLSRPRBSCSGR-UHFFFAOYSA-N |