2-[(4-nitrophenyl)methylidene]-1-benzothiophen-3(2H)-one
Chemical Structure Depiction of
2-[(4-nitrophenyl)methylidene]-1-benzothiophen-3(2H)-one
2-[(4-nitrophenyl)methylidene]-1-benzothiophen-3(2H)-one
Compound characteristics
| Compound ID: | 8645-0043 |
| Compound Name: | 2-[(4-nitrophenyl)methylidene]-1-benzothiophen-3(2H)-one |
| Molecular Weight: | 283.3 |
| Molecular Formula: | C15 H9 N O3 S |
| Smiles: | C(=C1/C(c2ccccc2S1)=O)\c1ccc(cc1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 3.8358 |
| logD: | 3.8358 |
| logSw: | -4.2924 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 46.781 |
| InChI Key: | PXHMYYSWROYWBS-UHFFFAOYSA-N |