N-(2-aminoethyl)-2-nitro-2-(5-nitro-1,3-dihydro-2H-benzimidazol-2-ylidene)acetamide
Chemical Structure Depiction of
N-(2-aminoethyl)-2-nitro-2-(5-nitro-1,3-dihydro-2H-benzimidazol-2-ylidene)acetamide
N-(2-aminoethyl)-2-nitro-2-(5-nitro-1,3-dihydro-2H-benzimidazol-2-ylidene)acetamide
Compound characteristics
| Compound ID: | 4872-0176 |
| Compound Name: | N-(2-aminoethyl)-2-nitro-2-(5-nitro-1,3-dihydro-2H-benzimidazol-2-ylidene)acetamide |
| Molecular Weight: | 308.25 |
| Molecular Formula: | C11 H12 N6 O5 |
| Smiles: | C(CNC(\C(=C1/Nc2ccc(cc2N1)[N+]([O-])=O)[N+]([O-])=O)=O)N |
| Stereo: | ACHIRAL |
| logP: | -0.0579 |
| logD: | -0.0579 |
| logSw: | -2.1746 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 5 |
| Polar surface area: | 134.179 |
| InChI Key: | GTGIVHXPCOFCEG-UHFFFAOYSA-N |