1-(1H-benzimidazol-1-yl)-2-(3-methyl-4-nitrophenoxy)ethan-1-one
Chemical Structure Depiction of
1-(1H-benzimidazol-1-yl)-2-(3-methyl-4-nitrophenoxy)ethan-1-one
1-(1H-benzimidazol-1-yl)-2-(3-methyl-4-nitrophenoxy)ethan-1-one
Compound characteristics
| Compound ID: | 8012-6326 |
| Compound Name: | 1-(1H-benzimidazol-1-yl)-2-(3-methyl-4-nitrophenoxy)ethan-1-one |
| Molecular Weight: | 311.29 |
| Molecular Formula: | C16 H13 N3 O4 |
| Smiles: | Cc1cc(ccc1[N+]([O-])=O)OCC(n1cnc2ccccc12)=O |
| Stereo: | ACHIRAL |
| logP: | 2.6319 |
| logD: | 2.6319 |
| logSw: | -2.848 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 64.131 |
| InChI Key: | GFCXYUGMIFILKA-UHFFFAOYSA-N |