2-iodo-6-methoxy-4-[(4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]phenyl acetate
Chemical Structure Depiction of
2-iodo-6-methoxy-4-[(4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]phenyl acetate
2-iodo-6-methoxy-4-[(4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]phenyl acetate
Compound characteristics
| Compound ID: | Y508-6714 |
| Compound Name: | 2-iodo-6-methoxy-4-[(4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]phenyl acetate |
| Molecular Weight: | 435.26 |
| Molecular Formula: | C13 H10 I N O4 S2 |
| Smiles: | CC(=O)Oc1c(cc(/C=C2/C(NC(=S)S2)=O)cc1I)OC |
| Stereo: | ACHIRAL |
| logP: | 2.0487 |
| logD: | 0.6975 |
| logSw: | -2.8521 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.455 |
| InChI Key: | CSMIIYIPBVTBDE-UHFFFAOYSA-N |