3-(5-{[4-(benzyloxy)-3-methoxyphenyl]methylidene}-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl)-1lambda~6~-thiolane-1,1-dione
Chemical Structure Depiction of
3-(5-{[4-(benzyloxy)-3-methoxyphenyl]methylidene}-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl)-1lambda~6~-thiolane-1,1-dione
3-(5-{[4-(benzyloxy)-3-methoxyphenyl]methylidene}-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl)-1lambda~6~-thiolane-1,1-dione
Compound characteristics
| Compound ID: | 4341-2000 |
| Compound Name: | 3-(5-{[4-(benzyloxy)-3-methoxyphenyl]methylidene}-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl)-1lambda~6~-thiolane-1,1-dione |
| Molecular Weight: | 475.6 |
| Molecular Formula: | C22 H21 N O5 S3 |
| Smiles: | COc1cc(/C=C2/C(N(C3CCS(C3)(=O)=O)C(=S)S2)=O)ccc1OCc1ccccc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.8446 |
| logD: | 2.8446 |
| logSw: | -3.4102 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 59.046 |
| InChI Key: | RVXVTFZGWSCFLZ-QGZVFWFLSA-N |