3-(5-{[3-(carboxymethyl)-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl}furan-2-yl)benzoic acid
Chemical Structure Depiction of
3-(5-{[3-(carboxymethyl)-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl}furan-2-yl)benzoic acid
3-(5-{[3-(carboxymethyl)-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl}furan-2-yl)benzoic acid
Compound characteristics
| Compound ID: | 4489-1015 |
| Compound Name: | 3-(5-{[3-(carboxymethyl)-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl}furan-2-yl)benzoic acid |
| Molecular Weight: | 389.4 |
| Molecular Formula: | C17 H11 N O6 S2 |
| Smiles: | C(C(O)=O)N1C(/C(=C\c2ccc(c3cccc(c3)C(O)=O)o2)SC1=S)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3482 |
| logD: | -1.1645 |
| logSw: | -2.4925 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 81.076 |
| InChI Key: | YYSBLZVXTCMYQK-UHFFFAOYSA-N |