2-ethoxy-6-iodo-4-[(4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]phenyl acetate
Chemical Structure Depiction of
2-ethoxy-6-iodo-4-[(4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]phenyl acetate
2-ethoxy-6-iodo-4-[(4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]phenyl acetate
Compound characteristics
| Compound ID: | Y508-6716 |
| Compound Name: | 2-ethoxy-6-iodo-4-[(4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]phenyl acetate |
| Molecular Weight: | 449.28 |
| Molecular Formula: | C14 H12 I N O4 S2 |
| Smiles: | CCOc1cc(/C=C2/C(NC(=S)S2)=O)cc(c1OC(C)=O)I |
| Stereo: | ACHIRAL |
| logP: | 2.3236 |
| logD: | 0.9724 |
| logSw: | -3.0234 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.035 |
| InChI Key: | LHLTXCVYYGDFDO-UHFFFAOYSA-N |