2-chloro-6-methoxy-4-[(4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]phenyl 4-methoxybenzoate
Chemical Structure Depiction of
2-chloro-6-methoxy-4-[(4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]phenyl 4-methoxybenzoate
2-chloro-6-methoxy-4-[(4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]phenyl 4-methoxybenzoate
Compound characteristics
| Compound ID: | 3681-1262 |
| Compound Name: | 2-chloro-6-methoxy-4-[(4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]phenyl 4-methoxybenzoate |
| Molecular Weight: | 435.9 |
| Molecular Formula: | C19 H14 Cl N O5 S2 |
| Smiles: | COc1ccc(cc1)C(=O)Oc1c(cc(/C=C2/C(NC(=S)S2)=O)cc1[Cl])OC |
| Stereo: | ACHIRAL |
| logP: | 3.7516 |
| logD: | 2.4005 |
| logSw: | -4.4256 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.625 |
| InChI Key: | BGUCGBFDLSIEMA-UHFFFAOYSA-N |