N-{2-[(azepan-1-yl)methyl]-1-butyl-1H-benzimidazol-5-yl}-2-(4-methylphenoxy)acetamide
Chemical Structure Depiction of
N-{2-[(azepan-1-yl)methyl]-1-butyl-1H-benzimidazol-5-yl}-2-(4-methylphenoxy)acetamide
N-{2-[(azepan-1-yl)methyl]-1-butyl-1H-benzimidazol-5-yl}-2-(4-methylphenoxy)acetamide
Compound characteristics
| Compound ID: | D332-0176 |
| Compound Name: | N-{2-[(azepan-1-yl)methyl]-1-butyl-1H-benzimidazol-5-yl}-2-(4-methylphenoxy)acetamide |
| Molecular Weight: | 448.61 |
| Molecular Formula: | C27 H36 N4 O2 |
| Smiles: | CCCCn1c2ccc(cc2nc1CN1CCCCCC1)NC(COc1ccc(C)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.7729 |
| logD: | 5.2049 |
| logSw: | -5.3355 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 45.834 |
| InChI Key: | TYHOSTKZPLCGJV-UHFFFAOYSA-N |