4-{[4-oxo-3-(prop-2-en-1-yl)-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl}phenyl 2-chlorobenzoate
Chemical Structure Depiction of
4-{[4-oxo-3-(prop-2-en-1-yl)-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl}phenyl 2-chlorobenzoate
4-{[4-oxo-3-(prop-2-en-1-yl)-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl}phenyl 2-chlorobenzoate
Compound characteristics
| Compound ID: | 3229-0194 |
| Compound Name: | 4-{[4-oxo-3-(prop-2-en-1-yl)-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl}phenyl 2-chlorobenzoate |
| Molecular Weight: | 415.92 |
| Molecular Formula: | C20 H14 Cl N O3 S2 |
| Smiles: | C=CCN1C(/C(=C\c2ccc(cc2)OC(c2ccccc2[Cl])=O)SC1=S)=O |
| Stereo: | ACHIRAL |
| logP: | 5.1263 |
| logD: | 5.1263 |
| logSw: | -5.4475 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 37.07 |
| InChI Key: | BIUUYGINKOTWNA-UHFFFAOYSA-N |