N-{2-[(azepan-1-yl)methyl]-1-methyl-1H-benzimidazol-5-yl}-4-chlorobenzamide
Chemical Structure Depiction of
N-{2-[(azepan-1-yl)methyl]-1-methyl-1H-benzimidazol-5-yl}-4-chlorobenzamide
N-{2-[(azepan-1-yl)methyl]-1-methyl-1H-benzimidazol-5-yl}-4-chlorobenzamide
Compound characteristics
| Compound ID: | D332-0050 |
| Compound Name: | N-{2-[(azepan-1-yl)methyl]-1-methyl-1H-benzimidazol-5-yl}-4-chlorobenzamide |
| Molecular Weight: | 396.92 |
| Molecular Formula: | C22 H25 Cl N4 O |
| Smiles: | Cn1c2ccc(cc2nc1CN1CCCCCC1)NC(c1ccc(cc1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 4.3948 |
| logD: | 4.1647 |
| logSw: | -4.5064 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 39.38 |
| InChI Key: | LGBOBEHKDFNFBJ-UHFFFAOYSA-N |