4-{[3-(4-methoxyphenyl)-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl}phenyl 2-iodobenzoate
Chemical Structure Depiction of
4-{[3-(4-methoxyphenyl)-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl}phenyl 2-iodobenzoate
4-{[3-(4-methoxyphenyl)-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl}phenyl 2-iodobenzoate
Compound characteristics
| Compound ID: | 2151-0834 |
| Compound Name: | 4-{[3-(4-methoxyphenyl)-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl}phenyl 2-iodobenzoate |
| Molecular Weight: | 573.43 |
| Molecular Formula: | C24 H16 I N O4 S2 |
| Smiles: | COc1ccc(cc1)N1C(/C(=C/c2ccc(cc2)OC(c2ccccc2I)=O)SC1=S)=O |
| Stereo: | ACHIRAL |
| logP: | 5.6639 |
| logD: | 5.6639 |
| logSw: | -5.6544 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 43.752 |
| InChI Key: | GTXKMHFNGMHSMH-UHFFFAOYSA-N |