methyl 3-{5-[(4-bromophenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}propanoate
Chemical Structure Depiction of
methyl 3-{5-[(4-bromophenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}propanoate
methyl 3-{5-[(4-bromophenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}propanoate
Compound characteristics
| Compound ID: | 3130-0981 |
| Compound Name: | methyl 3-{5-[(4-bromophenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}propanoate |
| Molecular Weight: | 386.28 |
| Molecular Formula: | C14 H12 Br N O3 S2 |
| Smiles: | COC(CCN1C(/C(=C\c2ccc(cc2)[Br])SC1=S)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4809 |
| logD: | 3.4809 |
| logSw: | -3.7065 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 37.271 |
| InChI Key: | VTCSGGNBPNJYKH-UHFFFAOYSA-N |