2-[(3-benzyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]-5-(4-methylanilino)-1,3-oxazole-4-carbonitrile
Chemical Structure Depiction of
2-[(3-benzyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]-5-(4-methylanilino)-1,3-oxazole-4-carbonitrile
2-[(3-benzyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]-5-(4-methylanilino)-1,3-oxazole-4-carbonitrile
Compound characteristics
| Compound ID: | Y070-0830 |
| Compound Name: | 2-[(3-benzyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]-5-(4-methylanilino)-1,3-oxazole-4-carbonitrile |
| Molecular Weight: | 432.52 |
| Molecular Formula: | C22 H16 N4 O2 S2 |
| Smiles: | Cc1ccc(cc1)Nc1c(C#N)nc(/C=C2/C(N(Cc3ccccc3)C(=S)S2)=O)o1 |
| Stereo: | ACHIRAL |
| logP: | 5.1443 |
| logD: | 5.1443 |
| logSw: | -4.9729 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.097 |
| InChI Key: | GKKDYADDLUUEFO-UHFFFAOYSA-N |