2-methoxy-4-({4-oxo-2-sulfanylidene-3-[3-(trifluoromethyl)phenyl]-1,3-thiazolidin-5-ylidene}methyl)phenyl benzoate
Chemical Structure Depiction of
2-methoxy-4-({4-oxo-2-sulfanylidene-3-[3-(trifluoromethyl)phenyl]-1,3-thiazolidin-5-ylidene}methyl)phenyl benzoate
2-methoxy-4-({4-oxo-2-sulfanylidene-3-[3-(trifluoromethyl)phenyl]-1,3-thiazolidin-5-ylidene}methyl)phenyl benzoate
Compound characteristics
| Compound ID: | 1996-0074 |
| Compound Name: | 2-methoxy-4-({4-oxo-2-sulfanylidene-3-[3-(trifluoromethyl)phenyl]-1,3-thiazolidin-5-ylidene}methyl)phenyl benzoate |
| Molecular Weight: | 515.53 |
| Molecular Formula: | C25 H16 F3 N O4 S2 |
| Smiles: | COc1cc(/C=C2/C(N(C(=S)S2)c2cccc(c2)C(F)(F)F)=O)ccc1OC(c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.7583 |
| logD: | 5.7583 |
| logSw: | -5.8213 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 43.926 |
| InChI Key: | QVJIGPSKOHLCTC-UHFFFAOYSA-N |