3-cyclohexyl-5-(5-methoxy-3-methyl-1,3-benzothiazol-2(3H)-ylidene)-2-(1-methyl-5-oxo-3-phenyl-2-sulfanylideneimidazolidin-4-ylidene)-1,3-thiazolidin-4-one
Chemical Structure Depiction of
3-cyclohexyl-5-(5-methoxy-3-methyl-1,3-benzothiazol-2(3H)-ylidene)-2-(1-methyl-5-oxo-3-phenyl-2-sulfanylideneimidazolidin-4-ylidene)-1,3-thiazolidin-4-one
3-cyclohexyl-5-(5-methoxy-3-methyl-1,3-benzothiazol-2(3H)-ylidene)-2-(1-methyl-5-oxo-3-phenyl-2-sulfanylideneimidazolidin-4-ylidene)-1,3-thiazolidin-4-one
Compound characteristics
| Compound ID: | 8009-7548 |
| Compound Name: | 3-cyclohexyl-5-(5-methoxy-3-methyl-1,3-benzothiazol-2(3H)-ylidene)-2-(1-methyl-5-oxo-3-phenyl-2-sulfanylideneimidazolidin-4-ylidene)-1,3-thiazolidin-4-one |
| Molecular Weight: | 564.75 |
| Molecular Formula: | C28 H28 N4 O3 S3 |
| Smiles: | CN1C(\C(=C2/N(C3CCCCC3)C(\C(=C3/N(C)c4cc(ccc4S3)OC)S2)=O)N(C1=S)c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.6061 |
| logD: | 5.6061 |
| logSw: | -5.2767 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 48.886 |
| InChI Key: | KRLFYHAGDUSKCV-UHFFFAOYSA-N |