4-[(3-benzyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]benzoic acid
Chemical Structure Depiction of
4-[(3-benzyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]benzoic acid
4-[(3-benzyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]benzoic acid
Compound characteristics
Compound ID: | 3229-0684 |
Compound Name: | 4-[(3-benzyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]benzoic acid |
Molecular Weight: | 355.43 |
Molecular Formula: | C18 H13 N O3 S2 |
Smiles: | C(c1ccccc1)N1C(/C(=C\c2ccc(cc2)C(O)=O)SC1=S)=O |
Stereo: | ACHIRAL |
logP: | 4.2572 |
logD: | 0.6504 |
logSw: | -4.341 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 44.85 |
InChI Key: | LAVHHMWKUVBWIF-UHFFFAOYSA-N |