5-[(1-ethyl-3-methyl-1H-pyrazol-4-yl)methylidene]-3-(propan-2-yl)-2-sulfanylidene-1,3-thiazolidin-4-one
Chemical Structure Depiction of
5-[(1-ethyl-3-methyl-1H-pyrazol-4-yl)methylidene]-3-(propan-2-yl)-2-sulfanylidene-1,3-thiazolidin-4-one
5-[(1-ethyl-3-methyl-1H-pyrazol-4-yl)methylidene]-3-(propan-2-yl)-2-sulfanylidene-1,3-thiazolidin-4-one
Compound characteristics
| Compound ID: | Y501-2603 |
| Compound Name: | 5-[(1-ethyl-3-methyl-1H-pyrazol-4-yl)methylidene]-3-(propan-2-yl)-2-sulfanylidene-1,3-thiazolidin-4-one |
| Molecular Weight: | 295.42 |
| Molecular Formula: | C13 H17 N3 O S2 |
| Smiles: | CCn1cc(/C=C2/C(N(C(C)C)C(=S)S2)=O)c(C)n1 |
| Stereo: | ACHIRAL |
| logP: | 2.3282 |
| logD: | 2.3282 |
| logSw: | -2.1013 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 31.2894 |
| InChI Key: | HQWITEMWZJRLKE-UHFFFAOYSA-N |