methyl {5-[2-(4-fluoroanilino)-2-oxoethyl]-4-oxo-3-phenyl-2-sulfanylideneimidazolidin-1-yl}acetate
Chemical Structure Depiction of
methyl {5-[2-(4-fluoroanilino)-2-oxoethyl]-4-oxo-3-phenyl-2-sulfanylideneimidazolidin-1-yl}acetate
methyl {5-[2-(4-fluoroanilino)-2-oxoethyl]-4-oxo-3-phenyl-2-sulfanylideneimidazolidin-1-yl}acetate
Compound characteristics
Compound ID: | 5593-0500 |
Compound Name: | methyl {5-[2-(4-fluoroanilino)-2-oxoethyl]-4-oxo-3-phenyl-2-sulfanylideneimidazolidin-1-yl}acetate |
Molecular Weight: | 415.44 |
Molecular Formula: | C20 H18 F N3 O4 S |
Smiles: | COC(CN1C(CC(Nc2ccc(cc2)F)=O)C(N(C1=S)c1ccccc1)=O)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 1.7242 |
logD: | 1.7237 |
logSw: | -2.4734 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 62.248 |
InChI Key: | XLPNCZDUVWDMAN-MRXNPFEDSA-N |