N-{2-[(azepan-1-yl)methyl]-1-propyl-1H-benzimidazol-5-yl}-3-methylbenzamide
Chemical Structure Depiction of
N-{2-[(azepan-1-yl)methyl]-1-propyl-1H-benzimidazol-5-yl}-3-methylbenzamide
N-{2-[(azepan-1-yl)methyl]-1-propyl-1H-benzimidazol-5-yl}-3-methylbenzamide
Compound characteristics
| Compound ID: | D332-0086 |
| Compound Name: | N-{2-[(azepan-1-yl)methyl]-1-propyl-1H-benzimidazol-5-yl}-3-methylbenzamide |
| Molecular Weight: | 404.55 |
| Molecular Formula: | C25 H32 N4 O |
| Smiles: | CCCn1c2ccc(cc2nc1CN1CCCCCC1)NC(c1cccc(C)c1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.2682 |
| logD: | 4.7001 |
| logSw: | -5.0902 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 38.548 |
| InChI Key: | PNUAYNZNCUMOEL-UHFFFAOYSA-N |