4-[(3-methylthiophen-2-yl)methylidene]-2-[2-(3-nitrophenyl)ethenyl]-1,3-oxazol-5(4H)-one
Chemical Structure Depiction of
4-[(3-methylthiophen-2-yl)methylidene]-2-[2-(3-nitrophenyl)ethenyl]-1,3-oxazol-5(4H)-one
4-[(3-methylthiophen-2-yl)methylidene]-2-[2-(3-nitrophenyl)ethenyl]-1,3-oxazol-5(4H)-one
Compound characteristics
| Compound ID: | K088-1017 |
| Compound Name: | 4-[(3-methylthiophen-2-yl)methylidene]-2-[2-(3-nitrophenyl)ethenyl]-1,3-oxazol-5(4H)-one |
| Molecular Weight: | 340.36 |
| Molecular Formula: | C17 H12 N2 O4 S |
| Smiles: | Cc1ccsc1/C=C1/C(=O)OC(/C=C/c2cccc(c2)[N+]([O-])=O)=N1 |
| Stereo: | ACHIRAL |
| logP: | 4.0864 |
| logD: | 4.0864 |
| logSw: | -4.3786 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 64.922 |
| InChI Key: | UAJXZDMKQZTNIR-UHFFFAOYSA-N |