4-({4-[(4-fluorophenyl)methyl]-2,3-dioxopiperazin-1-yl}methyl)-N-[(5-methylfuran-2-yl)methyl]benzamide
Chemical Structure Depiction of
4-({4-[(4-fluorophenyl)methyl]-2,3-dioxopiperazin-1-yl}methyl)-N-[(5-methylfuran-2-yl)methyl]benzamide
4-({4-[(4-fluorophenyl)methyl]-2,3-dioxopiperazin-1-yl}methyl)-N-[(5-methylfuran-2-yl)methyl]benzamide
Compound characteristics
| Compound ID: | M116-2293 |
| Compound Name: | 4-({4-[(4-fluorophenyl)methyl]-2,3-dioxopiperazin-1-yl}methyl)-N-[(5-methylfuran-2-yl)methyl]benzamide |
| Molecular Weight: | 449.48 |
| Molecular Formula: | C25 H24 F N3 O4 |
| Smiles: | Cc1ccc(CNC(c2ccc(CN3CCN(Cc4ccc(cc4)F)C(C3=O)=O)cc2)=O)o1 |
| Stereo: | ACHIRAL |
| logP: | 2.6974 |
| logD: | 2.6974 |
| logSw: | -2.866 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.96 |
| InChI Key: | CIVBRUHTIHOWBP-UHFFFAOYSA-N |