N-{5-[(4-chlorophenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}-4-nitrobenzamide
Chemical Structure Depiction of
N-{5-[(4-chlorophenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}-4-nitrobenzamide
N-{5-[(4-chlorophenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}-4-nitrobenzamide
Compound characteristics
| Compound ID: | 2189-0524 |
| Compound Name: | N-{5-[(4-chlorophenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}-4-nitrobenzamide |
| Molecular Weight: | 419.86 |
| Molecular Formula: | C17 H10 Cl N3 O4 S2 |
| Smiles: | C(=C1/C(N(C(=S)S1)NC(c1ccc(cc1)[N+]([O-])=O)=O)=O)/c1ccc(cc1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 3.697 |
| logD: | 3.6602 |
| logSw: | -4.6982 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.225 |
| InChI Key: | BCOMEHOHSQBSNB-UHFFFAOYSA-N |