2-chloro-4-[(4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]phenyl 4-methoxybenzoate
Chemical Structure Depiction of
2-chloro-4-[(4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]phenyl 4-methoxybenzoate
2-chloro-4-[(4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]phenyl 4-methoxybenzoate
Compound characteristics
| Compound ID: | 3681-1261 |
| Compound Name: | 2-chloro-4-[(4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]phenyl 4-methoxybenzoate |
| Molecular Weight: | 405.88 |
| Molecular Formula: | C18 H12 Cl N O4 S2 |
| Smiles: | COc1ccc(cc1)C(=O)Oc1ccc(/C=C2/C(NC(=S)S2)=O)cc1[Cl] |
| Stereo: | ACHIRAL |
| logP: | 3.2974 |
| logD: | 1.9463 |
| logSw: | -3.8739 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.908 |
| InChI Key: | XTGMAIGBOYYJGM-UHFFFAOYSA-N |