4-(2-{5-[(1,3-dimethyl-1H-pyrazol-4-yl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}ethyl)benzene-1-sulfonamide
Chemical Structure Depiction of
4-(2-{5-[(1,3-dimethyl-1H-pyrazol-4-yl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}ethyl)benzene-1-sulfonamide
4-(2-{5-[(1,3-dimethyl-1H-pyrazol-4-yl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}ethyl)benzene-1-sulfonamide
Compound characteristics
| Compound ID: | Y503-3407 |
| Compound Name: | 4-(2-{5-[(1,3-dimethyl-1H-pyrazol-4-yl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}ethyl)benzene-1-sulfonamide |
| Molecular Weight: | 422.55 |
| Molecular Formula: | C17 H18 N4 O3 S3 |
| Smiles: | Cc1c(\C=C2/C(N(CCc3ccc(cc3)S(N)(=O)=O)C(=S)S2)=O)cn(C)n1 |
| Stereo: | ACHIRAL |
| logP: | 1.2745 |
| logD: | 1.2737 |
| logSw: | -2.0853 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 82.186 |
| InChI Key: | CSHSKCSWAOCWGB-UHFFFAOYSA-N |