3-[2-(3,4-dimethoxyphenyl)ethyl]-5-[(1-methyl-1H-pyrazol-4-yl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one
Chemical Structure Depiction of
3-[2-(3,4-dimethoxyphenyl)ethyl]-5-[(1-methyl-1H-pyrazol-4-yl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one
3-[2-(3,4-dimethoxyphenyl)ethyl]-5-[(1-methyl-1H-pyrazol-4-yl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one
Compound characteristics
| Compound ID: | Y503-3406 |
| Compound Name: | 3-[2-(3,4-dimethoxyphenyl)ethyl]-5-[(1-methyl-1H-pyrazol-4-yl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one |
| Molecular Weight: | 389.49 |
| Molecular Formula: | C18 H19 N3 O3 S2 |
| Smiles: | Cn1cc(\C=C2/C(N(CCc3ccc(c(c3)OC)OC)C(=S)S2)=O)cn1 |
| Stereo: | ACHIRAL |
| logP: | 2.1753 |
| logD: | 2.1753 |
| logSw: | -2.5772 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 46.491 |
| InChI Key: | LNEOHJKAMHGAER-UHFFFAOYSA-N |