N-[2-(2-chloro-6-nitroanilino)ethyl]-4-ethoxy-3-nitrobenzamide
Chemical Structure Depiction of
N-[2-(2-chloro-6-nitroanilino)ethyl]-4-ethoxy-3-nitrobenzamide
N-[2-(2-chloro-6-nitroanilino)ethyl]-4-ethoxy-3-nitrobenzamide
Compound characteristics
| Compound ID: | 8012-1172 |
| Compound Name: | N-[2-(2-chloro-6-nitroanilino)ethyl]-4-ethoxy-3-nitrobenzamide |
| Molecular Weight: | 408.8 |
| Molecular Formula: | C17 H17 Cl N4 O6 |
| Smiles: | CCOc1ccc(cc1[N+]([O-])=O)C(NCCNc1c(cccc1[Cl])[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5995 |
| logD: | 2.5995 |
| logSw: | -3.5581 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 106.817 |
| InChI Key: | FXCHKTNEAJXDFQ-UHFFFAOYSA-N |