4-[(4-benzyl-2,3-dioxopiperazin-1-yl)methyl]-N-(3-fluorophenyl)benzamide
Chemical Structure Depiction of
4-[(4-benzyl-2,3-dioxopiperazin-1-yl)methyl]-N-(3-fluorophenyl)benzamide
4-[(4-benzyl-2,3-dioxopiperazin-1-yl)methyl]-N-(3-fluorophenyl)benzamide
Compound characteristics
Compound ID: | M116-1848 |
Compound Name: | 4-[(4-benzyl-2,3-dioxopiperazin-1-yl)methyl]-N-(3-fluorophenyl)benzamide |
Molecular Weight: | 431.47 |
Molecular Formula: | C25 H22 F N3 O3 |
Smiles: | C1CN(Cc2ccc(cc2)C(Nc2cccc(c2)F)=O)C(C(N1Cc1ccccc1)=O)=O |
Stereo: | ACHIRAL |
logP: | 3.0984 |
logD: | 3.092 |
logSw: | -3.3699 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 56.375 |
InChI Key: | ACFRULBBSWDUHQ-UHFFFAOYSA-N |