1-(azepan-1-yl)-2-{2-[(3,4-dimethoxyphenyl)methyl]-1H-benzimidazol-1-yl}ethan-1-one
Chemical Structure Depiction of
1-(azepan-1-yl)-2-{2-[(3,4-dimethoxyphenyl)methyl]-1H-benzimidazol-1-yl}ethan-1-one
1-(azepan-1-yl)-2-{2-[(3,4-dimethoxyphenyl)methyl]-1H-benzimidazol-1-yl}ethan-1-one
Compound characteristics
| Compound ID: | Y080-0223 |
| Compound Name: | 1-(azepan-1-yl)-2-{2-[(3,4-dimethoxyphenyl)methyl]-1H-benzimidazol-1-yl}ethan-1-one |
| Molecular Weight: | 407.51 |
| Molecular Formula: | C24 H29 N3 O3 |
| Smiles: | COc1ccc(Cc2nc3ccccc3n2CC(N2CCCCCC2)=O)cc1OC |
| Stereo: | ACHIRAL |
| logP: | 3.8281 |
| logD: | 3.7461 |
| logSw: | -4.0004 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 42.856 |
| InChI Key: | NKILRLDUNZGTPR-UHFFFAOYSA-N |