4-[(3-benzyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]phenyl 4-methylbenzoate
Chemical Structure Depiction of
4-[(3-benzyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]phenyl 4-methylbenzoate
4-[(3-benzyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]phenyl 4-methylbenzoate
Compound characteristics
| Compound ID: | Y070-0429 |
| Compound Name: | 4-[(3-benzyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]phenyl 4-methylbenzoate |
| Molecular Weight: | 445.56 |
| Molecular Formula: | C25 H19 N O3 S2 |
| Smiles: | Cc1ccc(cc1)C(=O)Oc1ccc(/C=C2/C(N(Cc3ccccc3)C(=S)S2)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 5.9319 |
| logD: | 5.9319 |
| logSw: | -5.6302 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 36.82 |
| InChI Key: | MHNOQLHXSBAWFE-UHFFFAOYSA-N |