4-[(3-benzyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]-2-methoxyphenyl 4-methylbenzoate
Chemical Structure Depiction of
4-[(3-benzyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]-2-methoxyphenyl 4-methylbenzoate
4-[(3-benzyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]-2-methoxyphenyl 4-methylbenzoate
Compound characteristics
| Compound ID: | 3972-1588 |
| Compound Name: | 4-[(3-benzyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]-2-methoxyphenyl 4-methylbenzoate |
| Molecular Weight: | 475.58 |
| Molecular Formula: | C26 H21 N O4 S2 |
| Smiles: | Cc1ccc(cc1)C(=O)Oc1ccc(\C=C2/C(N(Cc3ccccc3)C(=S)S2)=O)cc1OC |
| Stereo: | ACHIRAL |
| logP: | 5.8933 |
| logD: | 5.8933 |
| logSw: | -5.5798 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 44.537 |
| InChI Key: | XZXJQCIGHABCMS-UHFFFAOYSA-N |