3-[2-(3,4-dimethoxyphenyl)ethyl]-5-[(1,5-dimethyl-1H-pyrazol-4-yl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one
Chemical Structure Depiction of
3-[2-(3,4-dimethoxyphenyl)ethyl]-5-[(1,5-dimethyl-1H-pyrazol-4-yl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one
3-[2-(3,4-dimethoxyphenyl)ethyl]-5-[(1,5-dimethyl-1H-pyrazol-4-yl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one
Compound characteristics
| Compound ID: | Y503-1337 |
| Compound Name: | 3-[2-(3,4-dimethoxyphenyl)ethyl]-5-[(1,5-dimethyl-1H-pyrazol-4-yl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one |
| Molecular Weight: | 403.52 |
| Molecular Formula: | C19 H21 N3 O3 S2 |
| Smiles: | Cc1c(\C=C2/C(N(CCc3ccc(c(c3)OC)OC)C(=S)S2)=O)cnn1C |
| Stereo: | ACHIRAL |
| logP: | 2.5125 |
| logD: | 2.5125 |
| logSw: | -2.6937 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 46.168 |
| InChI Key: | RAVPMOUPDVNUED-UHFFFAOYSA-N |