N-[(2,4-difluorophenyl)methyl]-4-[(4-ethyl-2,3-dioxopiperazin-1-yl)methyl]benzamide
Chemical Structure Depiction of
N-[(2,4-difluorophenyl)methyl]-4-[(4-ethyl-2,3-dioxopiperazin-1-yl)methyl]benzamide
N-[(2,4-difluorophenyl)methyl]-4-[(4-ethyl-2,3-dioxopiperazin-1-yl)methyl]benzamide
Compound characteristics
| Compound ID: | M116-2788 |
| Compound Name: | N-[(2,4-difluorophenyl)methyl]-4-[(4-ethyl-2,3-dioxopiperazin-1-yl)methyl]benzamide |
| Molecular Weight: | 401.41 |
| Molecular Formula: | C21 H21 F2 N3 O3 |
| Smiles: | CCN1CCN(Cc2ccc(cc2)C(NCc2ccc(cc2F)F)=O)C(C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.0391 |
| logD: | 2.0391 |
| logSw: | -2.7729 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.693 |
| InChI Key: | SIJBINJLQZKAIF-UHFFFAOYSA-N |