N-{2-[(azepan-1-yl)methyl]-1-(propan-2-yl)-1H-benzimidazol-5-yl}-2-(4-chlorophenoxy)acetamide--hydrogen chloride (1/2)
Chemical Structure Depiction of
N-{2-[(azepan-1-yl)methyl]-1-(propan-2-yl)-1H-benzimidazol-5-yl}-2-(4-chlorophenoxy)acetamide--hydrogen chloride (1/2)
N-{2-[(azepan-1-yl)methyl]-1-(propan-2-yl)-1H-benzimidazol-5-yl}-2-(4-chlorophenoxy)acetamide--hydrogen chloride (1/2)
Compound characteristics
| Compound ID: | D332-0144 |
| Compound Name: | N-{2-[(azepan-1-yl)methyl]-1-(propan-2-yl)-1H-benzimidazol-5-yl}-2-(4-chlorophenoxy)acetamide--hydrogen chloride (1/2) |
| Molecular Weight: | 527.92 |
| Molecular Formula: | C25 H31 Cl N4 O2 |
| Salt: | 2HCl |
| Smiles: | CC(C)n1c2ccc(cc2nc1CN1CCCCCC1)NC(COc1ccc(cc1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 5.3199 |
| logD: | 5.1781 |
| logSw: | -5.807 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.931 |
| InChI Key: | UCAFJRVMJUTURS-UHFFFAOYSA-N |