2-methoxy-4-[(3-methyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]phenyl 4-methylbenzene-1-sulfonate
Chemical Structure Depiction of
2-methoxy-4-[(3-methyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]phenyl 4-methylbenzene-1-sulfonate
2-methoxy-4-[(3-methyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]phenyl 4-methylbenzene-1-sulfonate
Compound characteristics
| Compound ID: | 3229-2248 |
| Compound Name: | 2-methoxy-4-[(3-methyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]phenyl 4-methylbenzene-1-sulfonate |
| Molecular Weight: | 435.54 |
| Molecular Formula: | C19 H17 N O5 S3 |
| Smiles: | Cc1ccc(cc1)S(=O)(=O)Oc1ccc(\C=C2/C(N(C)C(=S)S2)=O)cc1OC |
| Stereo: | ACHIRAL |
| logP: | 3.5314 |
| logD: | 3.5314 |
| logSw: | -3.7581 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 59.958 |
| InChI Key: | COEXSEAIODHPPF-UHFFFAOYSA-N |