2-[(3-bromo-4-methoxyphenyl)methylidene]-1-benzothiophen-3(2H)-one
Chemical Structure Depiction of
2-[(3-bromo-4-methoxyphenyl)methylidene]-1-benzothiophen-3(2H)-one
2-[(3-bromo-4-methoxyphenyl)methylidene]-1-benzothiophen-3(2H)-one
Compound characteristics
| Compound ID: | 1690-0046 |
| Compound Name: | 2-[(3-bromo-4-methoxyphenyl)methylidene]-1-benzothiophen-3(2H)-one |
| Molecular Weight: | 347.23 |
| Molecular Formula: | C16 H11 Br O2 S |
| Smiles: | COc1ccc(/C=C2/C(c3ccccc3S2)=O)cc1[Br] |
| Stereo: | ACHIRAL |
| logP: | 4.2651 |
| logD: | 4.2651 |
| logSw: | -4.53 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 21.0303 |
| InChI Key: | IDNNDNUFRWFUMO-UHFFFAOYSA-N |