methyl 6-{5-[(4-butoxy-3-methoxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}hexanoate
Chemical Structure Depiction of
methyl 6-{5-[(4-butoxy-3-methoxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}hexanoate
methyl 6-{5-[(4-butoxy-3-methoxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}hexanoate
Compound characteristics
| Compound ID: | 3643-3121 |
| Compound Name: | methyl 6-{5-[(4-butoxy-3-methoxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}hexanoate |
| Molecular Weight: | 451.6 |
| Molecular Formula: | C22 H29 N O5 S2 |
| Smiles: | CCCCOc1ccc(/C=C2/C(N(CCCCCC(=O)OC)C(=S)S2)=O)cc1OC |
| Stereo: | ACHIRAL |
| logP: | 4.7452 |
| logD: | 4.7452 |
| logSw: | -4.47 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 52.406 |
| InChI Key: | LAHGSTJMVBOVTL-UHFFFAOYSA-N |