methyl 2-chloro-5-{5-[(4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]furan-2-yl}benzoate
Chemical Structure Depiction of
methyl 2-chloro-5-{5-[(4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]furan-2-yl}benzoate
methyl 2-chloro-5-{5-[(4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]furan-2-yl}benzoate
Compound characteristics
| Compound ID: | 2000-0278 |
| Compound Name: | methyl 2-chloro-5-{5-[(4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]furan-2-yl}benzoate |
| Molecular Weight: | 379.84 |
| Molecular Formula: | C16 H10 Cl N O4 S2 |
| Smiles: | COC(c1cc(ccc1[Cl])c1ccc(/C=C2/C(NC(=S)S2)=O)o1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5382 |
| logD: | 2.1466 |
| logSw: | -4.0837 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.644 |
| InChI Key: | GOETUEVFBJHTIO-UHFFFAOYSA-N |