5-bromo-3-[1-(4-ethoxyphenyl)-5-oxo-2-sulfanylideneimidazolidin-4-ylidene]-1,3-dihydro-2H-indol-2-one
Chemical Structure Depiction of
5-bromo-3-[1-(4-ethoxyphenyl)-5-oxo-2-sulfanylideneimidazolidin-4-ylidene]-1,3-dihydro-2H-indol-2-one
5-bromo-3-[1-(4-ethoxyphenyl)-5-oxo-2-sulfanylideneimidazolidin-4-ylidene]-1,3-dihydro-2H-indol-2-one
Compound characteristics
Compound ID: | 6236-4842 |
Compound Name: | 5-bromo-3-[1-(4-ethoxyphenyl)-5-oxo-2-sulfanylideneimidazolidin-4-ylidene]-1,3-dihydro-2H-indol-2-one |
Molecular Weight: | 444.3 |
Molecular Formula: | C19 H14 Br N3 O3 S |
Smiles: | CCOc1ccc(cc1)N1C(/C(=C2C(Nc3ccc(cc\23)[Br])=O)NC1=S)=O |
Stereo: | ACHIRAL |
logP: | 3.4727 |
logD: | 2.4883 |
logSw: | -3.7716 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 59.684 |
InChI Key: | DSLNOPVAGRQLDL-UHFFFAOYSA-N |