N-{2-[(azepan-1-yl)methyl]-1-methyl-1H-benzimidazol-5-yl}-4-tert-butylbenzamide
Chemical Structure Depiction of
N-{2-[(azepan-1-yl)methyl]-1-methyl-1H-benzimidazol-5-yl}-4-tert-butylbenzamide
N-{2-[(azepan-1-yl)methyl]-1-methyl-1H-benzimidazol-5-yl}-4-tert-butylbenzamide
Compound characteristics
| Compound ID: | D332-0058 |
| Compound Name: | N-{2-[(azepan-1-yl)methyl]-1-methyl-1H-benzimidazol-5-yl}-4-tert-butylbenzamide |
| Molecular Weight: | 418.58 |
| Molecular Formula: | C26 H34 N4 O |
| Smiles: | CC(C)(C)c1ccc(cc1)C(Nc1ccc2c(c1)nc(CN1CCCCCC1)n2C)=O |
| Stereo: | ACHIRAL |
| logP: | 5.5945 |
| logD: | 5.3653 |
| logSw: | -5.2182 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 39.38 |
| InChI Key: | VXXGADQDJADNGV-UHFFFAOYSA-N |