3,3'-[(4-ethoxyphenyl)methylene]bis(4-hydroxy-2H-1-benzothiopyran-2-one)
Chemical Structure Depiction of
3,3'-[(4-ethoxyphenyl)methylene]bis(4-hydroxy-2H-1-benzothiopyran-2-one)
3,3'-[(4-ethoxyphenyl)methylene]bis(4-hydroxy-2H-1-benzothiopyran-2-one)
Compound characteristics
Compound ID: | C270-0085 |
Compound Name: | 3,3'-[(4-ethoxyphenyl)methylene]bis(4-hydroxy-2H-1-benzothiopyran-2-one) |
Molecular Weight: | 488.58 |
Molecular Formula: | C27 H20 O5 S2 |
Smiles: | CCOc1ccc(cc1)C(C1=C(c2ccccc2SC1=O)O)C1=C(c2ccccc2SC1=O)O |
Stereo: | ACHIRAL |
logP: | 5.3794 |
logD: | 4.0306 |
logSw: | -5.3754 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 62.948 |
InChI Key: | LQAUWMRMHSYIMH-UHFFFAOYSA-N |