1-(5-nitro-1H-benzimidazol-2-yl)ethyl 4-nitrobenzoate
Chemical Structure Depiction of
1-(5-nitro-1H-benzimidazol-2-yl)ethyl 4-nitrobenzoate
1-(5-nitro-1H-benzimidazol-2-yl)ethyl 4-nitrobenzoate
Compound characteristics
| Compound ID: | 3291-1870 |
| Compound Name: | 1-(5-nitro-1H-benzimidazol-2-yl)ethyl 4-nitrobenzoate |
| Molecular Weight: | 356.29 |
| Molecular Formula: | C16 H12 N4 O6 |
| Smiles: | CC(c1nc2cc(ccc2[nH]1)[N+]([O-])=O)OC(c1ccc(cc1)[N+]([O-])=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.4627 |
| logD: | 3.4488 |
| logSw: | -3.8649 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 106.44 |
| InChI Key: | HYGBPXAQFJKRQO-VIFPVBQESA-N |