3-(5-{[5-(4-bromophenyl)furan-2-yl]methylidene}-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl)propanoic acid
Chemical Structure Depiction of
3-(5-{[5-(4-bromophenyl)furan-2-yl]methylidene}-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl)propanoic acid
3-(5-{[5-(4-bromophenyl)furan-2-yl]methylidene}-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl)propanoic acid
Compound characteristics
| Compound ID: | 4476-1437 |
| Compound Name: | 3-(5-{[5-(4-bromophenyl)furan-2-yl]methylidene}-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl)propanoic acid |
| Molecular Weight: | 438.32 |
| Molecular Formula: | C17 H12 Br N O4 S2 |
| Smiles: | C(CN1C(/C(=C/c2ccc(c3ccc(cc3)[Br])o2)SC1=S)=O)C(O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8068 |
| logD: | 1.2742 |
| logSw: | -4.0972 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.646 |
| InChI Key: | YQGDLHYELOLTHU-UHFFFAOYSA-N |