N-benzyl-4-({4-[(4-fluorophenyl)methyl]-2,3-dioxopiperazin-1-yl}methyl)benzamide
Chemical Structure Depiction of
N-benzyl-4-({4-[(4-fluorophenyl)methyl]-2,3-dioxopiperazin-1-yl}methyl)benzamide
N-benzyl-4-({4-[(4-fluorophenyl)methyl]-2,3-dioxopiperazin-1-yl}methyl)benzamide
Compound characteristics
Compound ID: | M116-2200 |
Compound Name: | N-benzyl-4-({4-[(4-fluorophenyl)methyl]-2,3-dioxopiperazin-1-yl}methyl)benzamide |
Molecular Weight: | 445.49 |
Molecular Formula: | C26 H24 F N3 O3 |
Smiles: | C(c1ccccc1)NC(c1ccc(CN2CCN(Cc3ccc(cc3)F)C(C2=O)=O)cc1)=O |
Stereo: | ACHIRAL |
logP: | 2.6399 |
logD: | 2.6399 |
logSw: | -2.8875 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 57.697 |
InChI Key: | GKNWRNFGPWJGFQ-UHFFFAOYSA-N |