2-methoxy-4-[(3-methyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]phenyl methanesulfonate
Chemical Structure Depiction of
2-methoxy-4-[(3-methyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]phenyl methanesulfonate
2-methoxy-4-[(3-methyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]phenyl methanesulfonate
Compound characteristics
| Compound ID: | 3229-1192 |
| Compound Name: | 2-methoxy-4-[(3-methyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]phenyl methanesulfonate |
| Molecular Weight: | 359.44 |
| Molecular Formula: | C13 H13 N O5 S3 |
| Smiles: | CN1C(/C(=C\c2ccc(c(c2)OC)OS(C)(=O)=O)SC1=S)=O |
| Stereo: | ACHIRAL |
| logP: | 1.4871 |
| logD: | 1.4871 |
| logSw: | -2.325 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 60.346 |
| InChI Key: | BEHIDYRNKCMUNV-UHFFFAOYSA-N |