bis{4-[(4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]phenyl} 2-nitrobenzene-1,4-dicarboxylate
Chemical Structure Depiction of
bis{4-[(4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]phenyl} 2-nitrobenzene-1,4-dicarboxylate
bis{4-[(4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]phenyl} 2-nitrobenzene-1,4-dicarboxylate
Compound characteristics
| Compound ID: | 8003-2064 |
| Compound Name: | bis{4-[(4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]phenyl} 2-nitrobenzene-1,4-dicarboxylate |
| Molecular Weight: | 649.7 |
| Molecular Formula: | C28 H15 N3 O8 S4 |
| Smiles: | C(=C1/C(NC(=S)S1)=O)/c1ccc(cc1)OC(c1ccc(C(=O)Oc2ccc(/C=C3/C(NC(=S)S3)=O)cc2)c(c1)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2128 |
| logD: | 1.8617 |
| logSw: | -3.8737 |
| Hydrogen bond acceptors count: | 20 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 123.398 |
| InChI Key: | HLPKVQLLEMSFEW-UHFFFAOYSA-N |