3-{[4-oxo-3-(prop-2-en-1-yl)-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl}phenyl benzoate
Chemical Structure Depiction of
3-{[4-oxo-3-(prop-2-en-1-yl)-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl}phenyl benzoate
3-{[4-oxo-3-(prop-2-en-1-yl)-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl}phenyl benzoate
Compound characteristics
| Compound ID: | 1538-0174 |
| Compound Name: | 3-{[4-oxo-3-(prop-2-en-1-yl)-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl}phenyl benzoate |
| Molecular Weight: | 381.47 |
| Molecular Formula: | C20 H15 N O3 S2 |
| Smiles: | C=CCN1C(/C(=C\c2cccc(c2)OC(c2ccccc2)=O)SC1=S)=O |
| Stereo: | ACHIRAL |
| logP: | 4.176 |
| logD: | 4.176 |
| logSw: | -4.4554 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 37.07 |
| InChI Key: | XPYFWNASLZQSPP-UHFFFAOYSA-N |