2-[(2,4-dimethylphenoxy)methyl]-5-nitro-1H-benzimidazole
Chemical Structure Depiction of
2-[(2,4-dimethylphenoxy)methyl]-5-nitro-1H-benzimidazole
2-[(2,4-dimethylphenoxy)methyl]-5-nitro-1H-benzimidazole
Compound characteristics
| Compound ID: | D347-1207 |
| Compound Name: | 2-[(2,4-dimethylphenoxy)methyl]-5-nitro-1H-benzimidazole |
| Molecular Weight: | 297.31 |
| Molecular Formula: | C16 H15 N3 O3 |
| Smiles: | Cc1ccc(c(C)c1)OCc1nc2cc(ccc2[nH]1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 4.4626 |
| logD: | 4.4429 |
| logSw: | -4.4795 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.216 |
| InChI Key: | WDMRFEUKSVJFBZ-UHFFFAOYSA-N |