N-{2-[(azepan-1-yl)methyl]-1-butyl-1H-benzimidazol-5-yl}-3-methylbutanamide
Chemical Structure Depiction of
N-{2-[(azepan-1-yl)methyl]-1-butyl-1H-benzimidazol-5-yl}-3-methylbutanamide
N-{2-[(azepan-1-yl)methyl]-1-butyl-1H-benzimidazol-5-yl}-3-methylbutanamide
Compound characteristics
| Compound ID: | D332-0156 |
| Compound Name: | N-{2-[(azepan-1-yl)methyl]-1-butyl-1H-benzimidazol-5-yl}-3-methylbutanamide |
| Molecular Weight: | 384.56 |
| Molecular Formula: | C23 H36 N4 O |
| Smiles: | CCCCn1c2ccc(cc2nc1CN1CCCCCC1)NC(CC(C)C)=O |
| Stereo: | ACHIRAL |
| logP: | 5.1134 |
| logD: | 4.5454 |
| logSw: | -4.9319 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 38.606 |
| InChI Key: | OPQSJRWOTCERPU-UHFFFAOYSA-N |