N-[1-(2H-1,3-benzodioxol-5-yl)ethyl]-2-(4-nitrophenyl)acetamide
Chemical Structure Depiction of
N-[1-(2H-1,3-benzodioxol-5-yl)ethyl]-2-(4-nitrophenyl)acetamide
N-[1-(2H-1,3-benzodioxol-5-yl)ethyl]-2-(4-nitrophenyl)acetamide
Compound characteristics
| Compound ID: | Y205-4699 |
| Compound Name: | N-[1-(2H-1,3-benzodioxol-5-yl)ethyl]-2-(4-nitrophenyl)acetamide |
| Molecular Weight: | 328.32 |
| Molecular Formula: | C17 H16 N2 O5 |
| Smiles: | CC(c1ccc2c(c1)OCO2)NC(Cc1ccc(cc1)[N+]([O-])=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.9302 |
| logD: | 2.9302 |
| logSw: | -3.4846 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.099 |
| InChI Key: | XBRRZVRGIGMIBT-NSHDSACASA-N |