methyl 4-{5-[(4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]furan-2-yl}benzoate
Chemical Structure Depiction of
methyl 4-{5-[(4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]furan-2-yl}benzoate
methyl 4-{5-[(4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]furan-2-yl}benzoate
Compound characteristics
| Compound ID: | 3584-0114 |
| Compound Name: | methyl 4-{5-[(4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]furan-2-yl}benzoate |
| Molecular Weight: | 345.39 |
| Molecular Formula: | C16 H11 N O4 S2 |
| Smiles: | COC(c1ccc(cc1)c1ccc(\C=C2/C(NC(=S)S2)=O)o1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0709 |
| logD: | 1.6793 |
| logSw: | -3.5642 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.644 |
| InChI Key: | YFJDSQQSNYMVOP-UHFFFAOYSA-N |