ethyl 4-(2-{4-[(2-methylphenyl)methyl]-2,3-dioxopiperazin-1-yl}acetamido)benzoate
Chemical Structure Depiction of
ethyl 4-(2-{4-[(2-methylphenyl)methyl]-2,3-dioxopiperazin-1-yl}acetamido)benzoate
ethyl 4-(2-{4-[(2-methylphenyl)methyl]-2,3-dioxopiperazin-1-yl}acetamido)benzoate
Compound characteristics
Compound ID: | F512-1512 |
Compound Name: | ethyl 4-(2-{4-[(2-methylphenyl)methyl]-2,3-dioxopiperazin-1-yl}acetamido)benzoate |
Molecular Weight: | 423.47 |
Molecular Formula: | C23 H25 N3 O5 |
Smiles: | CCOC(c1ccc(cc1)NC(CN1CCN(Cc2ccccc2C)C(C1=O)=O)=O)=O |
Stereo: | ACHIRAL |
logP: | 3.3467 |
logD: | 3.3466 |
logSw: | -3.2151 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 77.186 |
InChI Key: | OYJWRVQMLUPGRL-UHFFFAOYSA-N |