2-[2-(3-nitrophenyl)ethenyl]-4-[(2-nitrophenyl)methylidene]-1,3-oxazol-5(4H)-one
Chemical Structure Depiction of
2-[2-(3-nitrophenyl)ethenyl]-4-[(2-nitrophenyl)methylidene]-1,3-oxazol-5(4H)-one
2-[2-(3-nitrophenyl)ethenyl]-4-[(2-nitrophenyl)methylidene]-1,3-oxazol-5(4H)-one
Compound characteristics
Compound ID: | K088-1026 |
Compound Name: | 2-[2-(3-nitrophenyl)ethenyl]-4-[(2-nitrophenyl)methylidene]-1,3-oxazol-5(4H)-one |
Molecular Weight: | 365.3 |
Molecular Formula: | C18 H11 N3 O6 |
Smiles: | C(=C\c1cccc(c1)[N+]([O-])=O)\C1=NC(=C\c2ccccc2[N+]([O-])=O)\C(=O)O1 |
Stereo: | ACHIRAL |
logP: | 3.6901 |
logD: | 3.6901 |
logSw: | -4.2746 |
Hydrogen bond acceptors count: | 12 |
Polar surface area: | 96.984 |
InChI Key: | SXJYQERUXVLEJO-UHFFFAOYSA-N |