5-[(3-bromo-4-hydroxy-5-methoxyphenyl)methylidene]-3-methyl-2-sulfanylidene-1,3-thiazolidin-4-one
Chemical Structure Depiction of
5-[(3-bromo-4-hydroxy-5-methoxyphenyl)methylidene]-3-methyl-2-sulfanylidene-1,3-thiazolidin-4-one
5-[(3-bromo-4-hydroxy-5-methoxyphenyl)methylidene]-3-methyl-2-sulfanylidene-1,3-thiazolidin-4-one
Compound characteristics
| Compound ID: | 3229-0721 |
| Compound Name: | 5-[(3-bromo-4-hydroxy-5-methoxyphenyl)methylidene]-3-methyl-2-sulfanylidene-1,3-thiazolidin-4-one |
| Molecular Weight: | 360.25 |
| Molecular Formula: | C12 H10 Br N O3 S2 |
| Smiles: | CN1C(/C(=C\c2cc(c(c(c2)[Br])O)OC)SC1=S)=O |
| Stereo: | ACHIRAL |
| logP: | 2.434 |
| logD: | 2.3563 |
| logSw: | -2.2424 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 39.589 |
| InChI Key: | SUJMGDLBTPFCMK-UHFFFAOYSA-N |