3-[(azepan-1-yl)methyl]-5-[(4-methylphenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one
Chemical Structure Depiction of
3-[(azepan-1-yl)methyl]-5-[(4-methylphenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one
3-[(azepan-1-yl)methyl]-5-[(4-methylphenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one
Compound characteristics
| Compound ID: | 8009-6065 |
| Compound Name: | 3-[(azepan-1-yl)methyl]-5-[(4-methylphenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one |
| Molecular Weight: | 346.51 |
| Molecular Formula: | C18 H22 N2 O S2 |
| Smiles: | Cc1ccc(/C=C2/C(N(CN3CCCCCC3)C(=S)S2)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.5107 |
| logD: | 3.2658 |
| logSw: | -4.1161 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 22.1996 |
| InChI Key: | BTXSDJBPTOAAQC-UHFFFAOYSA-N |