methyl 4-({1-[2-(4-methylanilino)-2-oxoethyl]-2,5-dioxoimidazolidin-4-ylidene}methyl)benzoate
Chemical Structure Depiction of
methyl 4-({1-[2-(4-methylanilino)-2-oxoethyl]-2,5-dioxoimidazolidin-4-ylidene}methyl)benzoate
methyl 4-({1-[2-(4-methylanilino)-2-oxoethyl]-2,5-dioxoimidazolidin-4-ylidene}methyl)benzoate
Compound characteristics
Compound ID: | 4998-1037 |
Compound Name: | methyl 4-({1-[2-(4-methylanilino)-2-oxoethyl]-2,5-dioxoimidazolidin-4-ylidene}methyl)benzoate |
Molecular Weight: | 393.4 |
Molecular Formula: | C21 H19 N3 O5 |
Smiles: | Cc1ccc(cc1)NC(CN1C(/C(=C\c2ccc(cc2)C(=O)OC)NC1=O)=O)=O |
Stereo: | ACHIRAL |
logP: | 3.221 |
logD: | 3.2209 |
logSw: | -3.404 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 84.994 |
InChI Key: | MXRXXXIMAFTJRT-UHFFFAOYSA-N |