N-[2-(1H-benzimidazol-2-yl)ethyl]-3,5-dinitrobenzamide
Chemical Structure Depiction of
N-[2-(1H-benzimidazol-2-yl)ethyl]-3,5-dinitrobenzamide
N-[2-(1H-benzimidazol-2-yl)ethyl]-3,5-dinitrobenzamide
Compound characteristics
| Compound ID: | 1682-7855 |
| Compound Name: | N-[2-(1H-benzimidazol-2-yl)ethyl]-3,5-dinitrobenzamide |
| Molecular Weight: | 355.31 |
| Molecular Formula: | C16 H13 N5 O5 |
| Smiles: | C(CNC(c1cc(cc(c1)[N+]([O-])=O)[N+]([O-])=O)=O)c1nc2ccccc2[nH]1 |
| Stereo: | ACHIRAL |
| logP: | 2.4626 |
| logD: | 2.4619 |
| logSw: | -2.9601 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 111.538 |
| InChI Key: | XHFWWPFWSUJCDP-UHFFFAOYSA-N |