4-[(3-benzyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]benzonitrile
Chemical Structure Depiction of
4-[(3-benzyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]benzonitrile
4-[(3-benzyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]benzonitrile
Compound characteristics
| Compound ID: | 3972-1979 |
| Compound Name: | 4-[(3-benzyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]benzonitrile |
| Molecular Weight: | 336.43 |
| Molecular Formula: | C18 H12 N2 O S2 |
| Smiles: | C(c1ccccc1)N1C(/C(=C\c2ccc(C#N)cc2)SC1=S)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0634 |
| logD: | 4.0634 |
| logSw: | -4.3898 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 33.499 |
| InChI Key: | RRKVGDWVHKFVNS-UHFFFAOYSA-N |