3-{4-oxo-5-[(pyridin-3-yl)methylidene]-2-sulfanylidene-1,3-thiazolidin-3-yl}benzoic acid
Chemical Structure Depiction of
3-{4-oxo-5-[(pyridin-3-yl)methylidene]-2-sulfanylidene-1,3-thiazolidin-3-yl}benzoic acid
3-{4-oxo-5-[(pyridin-3-yl)methylidene]-2-sulfanylidene-1,3-thiazolidin-3-yl}benzoic acid
Compound characteristics
| Compound ID: | 4300-0218 |
| Compound Name: | 3-{4-oxo-5-[(pyridin-3-yl)methylidene]-2-sulfanylidene-1,3-thiazolidin-3-yl}benzoic acid |
| Molecular Weight: | 342.39 |
| Molecular Formula: | C16 H10 N2 O3 S2 |
| Smiles: | C(=C1/C(N(C(=S)S1)c1cccc(c1)C(O)=O)=O)/c1cccnc1 |
| Stereo: | ACHIRAL |
| logP: | 2.7231 |
| logD: | 0.0335 |
| logSw: | -2.7141 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.757 |
| InChI Key: | TWIPVBVDCIVKBB-UHFFFAOYSA-N |