methyl 4-[(4-oxo-3-propyl-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]benzoate
Chemical Structure Depiction of
methyl 4-[(4-oxo-3-propyl-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]benzoate
methyl 4-[(4-oxo-3-propyl-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]benzoate
Compound characteristics
| Compound ID: | 3229-2066 |
| Compound Name: | methyl 4-[(4-oxo-3-propyl-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]benzoate |
| Molecular Weight: | 321.41 |
| Molecular Formula: | C15 H15 N O3 S2 |
| Smiles: | CCCN1C(/C(=C\c2ccc(cc2)C(=O)OC)SC1=S)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6871 |
| logD: | 3.6871 |
| logSw: | -4.0151 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 37.866 |
| InChI Key: | WZEDYBNGSHAXFW-UHFFFAOYSA-N |