2-(2-methoxy-5-nitrophenyl)-4-[(3-methylthiophen-2-yl)methylidene]-1,3-oxazol-5(4H)-one
Chemical Structure Depiction of
2-(2-methoxy-5-nitrophenyl)-4-[(3-methylthiophen-2-yl)methylidene]-1,3-oxazol-5(4H)-one
2-(2-methoxy-5-nitrophenyl)-4-[(3-methylthiophen-2-yl)methylidene]-1,3-oxazol-5(4H)-one
Compound characteristics
| Compound ID: | K088-1421 |
| Compound Name: | 2-(2-methoxy-5-nitrophenyl)-4-[(3-methylthiophen-2-yl)methylidene]-1,3-oxazol-5(4H)-one |
| Molecular Weight: | 344.34 |
| Molecular Formula: | C16 H12 N2 O5 S |
| Smiles: | Cc1ccsc1/C=C1/C(=O)OC(c2cc(ccc2OC)[N+]([O-])=O)=N1 |
| Stereo: | ACHIRAL |
| logP: | 3.1767 |
| logD: | 3.1767 |
| logSw: | -3.6184 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 72.406 |
| InChI Key: | BFWZFVJQBIFOKK-UHFFFAOYSA-N |