2-[(3,5-dibromo-2-hydroxyphenyl)methylidene]-1-benzothiophen-3(2H)-one
Chemical Structure Depiction of
2-[(3,5-dibromo-2-hydroxyphenyl)methylidene]-1-benzothiophen-3(2H)-one
2-[(3,5-dibromo-2-hydroxyphenyl)methylidene]-1-benzothiophen-3(2H)-one
Compound characteristics
| Compound ID: | 2729-0280 |
| Compound Name: | 2-[(3,5-dibromo-2-hydroxyphenyl)methylidene]-1-benzothiophen-3(2H)-one |
| Molecular Weight: | 412.1 |
| Molecular Formula: | C15 H8 Br2 O2 S |
| Smiles: | C(=C1/C(c2ccccc2S1)=O)/c1cc(cc(c1O)[Br])[Br] |
| Stereo: | ACHIRAL |
| logP: | 5.2681 |
| logD: | 3.885 |
| logSw: | -5.2472 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 28.879 |
| InChI Key: | KGCDNURBZSYZIO-UHFFFAOYSA-N |