N-{2-[(azepan-1-yl)methyl]-1-butyl-1H-benzimidazol-5-yl}-2-methylpropanamide
Chemical Structure Depiction of
N-{2-[(azepan-1-yl)methyl]-1-butyl-1H-benzimidazol-5-yl}-2-methylpropanamide
N-{2-[(azepan-1-yl)methyl]-1-butyl-1H-benzimidazol-5-yl}-2-methylpropanamide
Compound characteristics
| Compound ID: | D332-0155 |
| Compound Name: | N-{2-[(azepan-1-yl)methyl]-1-butyl-1H-benzimidazol-5-yl}-2-methylpropanamide |
| Molecular Weight: | 370.54 |
| Molecular Formula: | C22 H34 N4 O |
| Smiles: | CCCCn1c2ccc(cc2nc1CN1CCCCCC1)NC(C(C)C)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6555 |
| logD: | 4.0875 |
| logSw: | -4.1639 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 38.82 |
| InChI Key: | CMUPYGJONCRICR-UHFFFAOYSA-N |