N-{2-[(azepan-1-yl)methyl]-1-butyl-1H-benzimidazol-5-yl}-2-(2-methylphenoxy)acetamide
Chemical Structure Depiction of
N-{2-[(azepan-1-yl)methyl]-1-butyl-1H-benzimidazol-5-yl}-2-(2-methylphenoxy)acetamide
N-{2-[(azepan-1-yl)methyl]-1-butyl-1H-benzimidazol-5-yl}-2-(2-methylphenoxy)acetamide
Compound characteristics
| Compound ID: | D332-0178 |
| Compound Name: | N-{2-[(azepan-1-yl)methyl]-1-butyl-1H-benzimidazol-5-yl}-2-(2-methylphenoxy)acetamide |
| Molecular Weight: | 448.61 |
| Molecular Formula: | C27 H36 N4 O2 |
| Smiles: | CCCCn1c2ccc(cc2nc1CN1CCCCCC1)NC(COc1ccccc1C)=O |
| Stereo: | ACHIRAL |
| logP: | 5.8242 |
| logD: | 5.2562 |
| logSw: | -5.3832 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 45.92 |
| InChI Key: | BWJYTKLGUHWLMP-UHFFFAOYSA-N |