4-bromo-N-{5-[(4-methoxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}benzamide
Chemical Structure Depiction of
4-bromo-N-{5-[(4-methoxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}benzamide
4-bromo-N-{5-[(4-methoxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}benzamide
Compound characteristics
Compound ID: | 3232-0135 |
Compound Name: | 4-bromo-N-{5-[(4-methoxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}benzamide |
Molecular Weight: | 449.34 |
Molecular Formula: | C18 H13 Br N2 O3 S2 |
Smiles: | COc1ccc(/C=C2/C(N(C(=S)S2)NC(c2ccc(cc2)[Br])=O)=O)cc1 |
Stereo: | ACHIRAL |
logP: | 3.9929 |
logD: | 3.8114 |
logSw: | -4.2707 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 50.387 |
InChI Key: | FSOUXXDXFUISQG-UHFFFAOYSA-N |