3-methyl-4-{5-[(4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]furan-2-yl}benzoic acid
Chemical Structure Depiction of
3-methyl-4-{5-[(4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]furan-2-yl}benzoic acid
3-methyl-4-{5-[(4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]furan-2-yl}benzoic acid
Compound characteristics
| Compound ID: | 4299-0716 |
| Compound Name: | 3-methyl-4-{5-[(4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]furan-2-yl}benzoic acid |
| Molecular Weight: | 345.39 |
| Molecular Formula: | C16 H11 N O4 S2 |
| Smiles: | Cc1cc(ccc1c1ccc(/C=C2/C(NC(=S)S2)=O)o1)C(O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1338 |
| logD: | -0.1013 |
| logSw: | -3.2944 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 60.878 |
| InChI Key: | OYNKFXBZEGBQQM-UHFFFAOYSA-N |