5-(5-{[4-oxo-3-(prop-2-en-1-yl)-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl}furan-2-yl)benzene-1,3-dicarboxylic acid
Chemical Structure Depiction of
5-(5-{[4-oxo-3-(prop-2-en-1-yl)-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl}furan-2-yl)benzene-1,3-dicarboxylic acid
5-(5-{[4-oxo-3-(prop-2-en-1-yl)-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl}furan-2-yl)benzene-1,3-dicarboxylic acid
Compound characteristics
| Compound ID: | 4490-1964 |
| Compound Name: | 5-(5-{[4-oxo-3-(prop-2-en-1-yl)-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl}furan-2-yl)benzene-1,3-dicarboxylic acid |
| Molecular Weight: | 415.44 |
| Molecular Formula: | C19 H13 N O6 S2 |
| Smiles: | C=CCN1C(/C(=C\c2ccc(c3cc(cc(c3)C(O)=O)C(O)=O)o2)SC1=S)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2353 |
| logD: | 0.2448 |
| logSw: | -4.2686 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 81.078 |
| InChI Key: | KFIUTZKPQHPAMP-OQLLNIDSSA-N |