3-(5-nitro-1H-benzimidazol-2-yl)propyl cyclohexanecarboxylate
Chemical Structure Depiction of
3-(5-nitro-1H-benzimidazol-2-yl)propyl cyclohexanecarboxylate
3-(5-nitro-1H-benzimidazol-2-yl)propyl cyclohexanecarboxylate
Compound characteristics
| Compound ID: | 1659-1417 |
| Compound Name: | 3-(5-nitro-1H-benzimidazol-2-yl)propyl cyclohexanecarboxylate |
| Molecular Weight: | 331.37 |
| Molecular Formula: | C17 H21 N3 O4 |
| Smiles: | C1CCC(CC1)C(=O)OCCCc1nc2cc(ccc2[nH]1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 4.1744 |
| logD: | 4.1605 |
| logSw: | -4.2818 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.87 |
| InChI Key: | GHOBYVVKDCWFAU-UHFFFAOYSA-N |