3-[2-(4-benzylpiperidin-1-yl)-2-oxoethyl]-5-[(4-methylphenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one
Chemical Structure Depiction of
3-[2-(4-benzylpiperidin-1-yl)-2-oxoethyl]-5-[(4-methylphenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one
3-[2-(4-benzylpiperidin-1-yl)-2-oxoethyl]-5-[(4-methylphenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one
Compound characteristics
| Compound ID: | 4491-2082 |
| Compound Name: | 3-[2-(4-benzylpiperidin-1-yl)-2-oxoethyl]-5-[(4-methylphenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one |
| Molecular Weight: | 450.62 |
| Molecular Formula: | C25 H26 N2 O2 S2 |
| Smiles: | Cc1ccc(/C=C2/C(N(CC(N3CCC(CC3)Cc3ccccc3)=O)C(=S)S2)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 5.1375 |
| logD: | 5.1375 |
| logSw: | -5.0788 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 32.563 |
| InChI Key: | CYCGDWJGGTWCBM-UHFFFAOYSA-N |