5-[(3-bromo-4-hydroxy-5-methoxyphenyl)methylidene]-3-cyclohexyl-1-methyl-2-sulfanylideneimidazolidin-4-one
Chemical Structure Depiction of
5-[(3-bromo-4-hydroxy-5-methoxyphenyl)methylidene]-3-cyclohexyl-1-methyl-2-sulfanylideneimidazolidin-4-one
5-[(3-bromo-4-hydroxy-5-methoxyphenyl)methylidene]-3-cyclohexyl-1-methyl-2-sulfanylideneimidazolidin-4-one
Compound characteristics
Compound ID: | 5792-8168 |
Compound Name: | 5-[(3-bromo-4-hydroxy-5-methoxyphenyl)methylidene]-3-cyclohexyl-1-methyl-2-sulfanylideneimidazolidin-4-one |
Molecular Weight: | 425.34 |
Molecular Formula: | C18 H21 Br N2 O3 S |
Smiles: | CN1C(=C/c2cc(c(c(c2)[Br])O)OC)\C(N(C2CCCCC2)C1=S)=O |
Stereo: | ACHIRAL |
logP: | 3.5278 |
logD: | 3.4501 |
logSw: | -3.6757 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 40.244 |
InChI Key: | JNFHGEVWNNKXJV-UHFFFAOYSA-N |