N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-(4-benzyl-2,3-dioxopiperazin-1-yl)acetamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-(4-benzyl-2,3-dioxopiperazin-1-yl)acetamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-(4-benzyl-2,3-dioxopiperazin-1-yl)acetamide
Compound characteristics
| Compound ID: | F512-0199 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-(4-benzyl-2,3-dioxopiperazin-1-yl)acetamide |
| Molecular Weight: | 395.41 |
| Molecular Formula: | C21 H21 N3 O5 |
| Smiles: | [H]C(C(NCc1ccc2c(c1)OCO2)=O)N1CCN(Cc2ccccc2)C(C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.3316 |
| logD: | 1.3316 |
| logSw: | -2.1567 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.87 |
| InChI Key: | CGBVFHMHZNKUON-UHFFFAOYSA-N |