N-(adamantan-1-yl)-3-{5-[(2H-1,3-benzodioxol-5-yl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}propanamide
Chemical Structure Depiction of
N-(adamantan-1-yl)-3-{5-[(2H-1,3-benzodioxol-5-yl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}propanamide
N-(adamantan-1-yl)-3-{5-[(2H-1,3-benzodioxol-5-yl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}propanamide
Compound characteristics
| Compound ID: | 3643-0638 |
| Compound Name: | N-(adamantan-1-yl)-3-{5-[(2H-1,3-benzodioxol-5-yl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}propanamide |
| Molecular Weight: | 470.61 |
| Molecular Formula: | C24 H26 N2 O4 S2 |
| Smiles: | C(CN1C(/C(=C/c2ccc3c(c2)OCO3)SC1=S)=O)C(NC12CC3CC(CC(C3)C2)C1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5809 |
| logD: | 4.5809 |
| logSw: | -4.4711 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.703 |
| InChI Key: | METWJYDQGIFTNJ-UHFFFAOYSA-N |