2-methoxy-4-[(3-methyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]phenyl 4-fluorobenzene-1-sulfonate
Chemical Structure Depiction of
2-methoxy-4-[(3-methyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]phenyl 4-fluorobenzene-1-sulfonate
2-methoxy-4-[(3-methyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]phenyl 4-fluorobenzene-1-sulfonate
Compound characteristics
| Compound ID: | 3229-2264 |
| Compound Name: | 2-methoxy-4-[(3-methyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]phenyl 4-fluorobenzene-1-sulfonate |
| Molecular Weight: | 439.5 |
| Molecular Formula: | C18 H14 F N O5 S3 |
| Smiles: | CN1C(/C(=C\c2ccc(c(c2)OC)OS(c2ccc(cc2)F)(=O)=O)SC1=S)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1371 |
| logD: | 3.1371 |
| logSw: | -3.4667 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 59.958 |
| InChI Key: | XGBWICAFXAYVKS-UHFFFAOYSA-N |