2-[(2,6-dichloro-3-nitrophenyl)methylidene]-1-benzothiophen-3(2H)-one
Chemical Structure Depiction of
2-[(2,6-dichloro-3-nitrophenyl)methylidene]-1-benzothiophen-3(2H)-one
2-[(2,6-dichloro-3-nitrophenyl)methylidene]-1-benzothiophen-3(2H)-one
Compound characteristics
| Compound ID: | 1809-0094 |
| Compound Name: | 2-[(2,6-dichloro-3-nitrophenyl)methylidene]-1-benzothiophen-3(2H)-one |
| Molecular Weight: | 352.19 |
| Molecular Formula: | C15 H7 Cl2 N O3 S |
| Smiles: | C(=C1/C(c2ccccc2S1)=O)/c1c(ccc(c1[Cl])[N+]([O-])=O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 4.7264 |
| logD: | 4.7264 |
| logSw: | -5.1341 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 46.48 |
| InChI Key: | QJVFHTWZTSYURP-UHFFFAOYSA-N |