N-(2H-1,3-benzodioxol-5-yl)-2-methyl-3-nitrobenzamide
Chemical Structure Depiction of
N-(2H-1,3-benzodioxol-5-yl)-2-methyl-3-nitrobenzamide
N-(2H-1,3-benzodioxol-5-yl)-2-methyl-3-nitrobenzamide
Compound characteristics
| Compound ID: | 2043-3846 |
| Compound Name: | N-(2H-1,3-benzodioxol-5-yl)-2-methyl-3-nitrobenzamide |
| Molecular Weight: | 300.27 |
| Molecular Formula: | C15 H12 N2 O5 |
| Smiles: | Cc1c(cccc1[N+]([O-])=O)C(Nc1ccc2c(c1)OCO2)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0948 |
| logD: | 3.035 |
| logSw: | -3.6646 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.526 |
| InChI Key: | CIWCROPMXVOIPE-UHFFFAOYSA-N |