N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-nitrobenzamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-nitrobenzamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-nitrobenzamide
Compound characteristics
| Compound ID: | 8012-0703 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-nitrobenzamide |
| Molecular Weight: | 300.27 |
| Molecular Formula: | C15 H12 N2 O5 |
| Smiles: | C(c1ccc2c(c1)OCO2)NC(c1ccccc1[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5864 |
| logD: | 2.5862 |
| logSw: | -3.396 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.848 |
| InChI Key: | OMJZRSQMOPOMRS-UHFFFAOYSA-N |