(5-{[5-(2-chloro-5-nitrophenyl)furan-2-yl]methylidene}-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl)acetic acid
Chemical Structure Depiction of
(5-{[5-(2-chloro-5-nitrophenyl)furan-2-yl]methylidene}-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl)acetic acid
(5-{[5-(2-chloro-5-nitrophenyl)furan-2-yl]methylidene}-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl)acetic acid
Compound characteristics
| Compound ID: | 3229-2104 |
| Compound Name: | (5-{[5-(2-chloro-5-nitrophenyl)furan-2-yl]methylidene}-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl)acetic acid |
| Molecular Weight: | 424.84 |
| Molecular Formula: | C16 H9 Cl N2 O6 S2 |
| Smiles: | C(C(O)=O)N1C(/C(=C\c2ccc(c3cc(ccc3[Cl])[N+]([O-])=O)o2)SC1=S)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9086 |
| logD: | -0.2103 |
| logSw: | -3.5495 |
| Hydrogen bond acceptors count: | 13 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 86.049 |
| InChI Key: | HAMXKLVFKPINFK-UHFFFAOYSA-N |