dimethyl 2-[4-oxo-5-(3-phenylprop-2-en-1-ylidene)-2-sulfanylidene-1,3-thiazolidin-3-yl]butanedioate
Chemical Structure Depiction of
dimethyl 2-[4-oxo-5-(3-phenylprop-2-en-1-ylidene)-2-sulfanylidene-1,3-thiazolidin-3-yl]butanedioate
dimethyl 2-[4-oxo-5-(3-phenylprop-2-en-1-ylidene)-2-sulfanylidene-1,3-thiazolidin-3-yl]butanedioate
Compound characteristics
| Compound ID: | 4162-0460 |
| Compound Name: | dimethyl 2-[4-oxo-5-(3-phenylprop-2-en-1-ylidene)-2-sulfanylidene-1,3-thiazolidin-3-yl]butanedioate |
| Molecular Weight: | 391.46 |
| Molecular Formula: | C18 H17 N O5 S2 |
| Smiles: | COC(CC(C(=O)OC)N1C(/C(=C/C=C/c2ccccc2)SC1=S)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.9659 |
| logD: | 2.9659 |
| logSw: | -3.1888 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 57.392 |
| InChI Key: | XCLVUASGBWIIHX-ZDUSSCGKSA-N |