N-{2-[(azepan-1-yl)methyl]-1-ethyl-1H-benzimidazol-5-yl}-2-(4-chloro-3-methylphenoxy)acetamide
Chemical Structure Depiction of
N-{2-[(azepan-1-yl)methyl]-1-ethyl-1H-benzimidazol-5-yl}-2-(4-chloro-3-methylphenoxy)acetamide
N-{2-[(azepan-1-yl)methyl]-1-ethyl-1H-benzimidazol-5-yl}-2-(4-chloro-3-methylphenoxy)acetamide
Compound characteristics
| Compound ID: | D332-0037 |
| Compound Name: | N-{2-[(azepan-1-yl)methyl]-1-ethyl-1H-benzimidazol-5-yl}-2-(4-chloro-3-methylphenoxy)acetamide |
| Molecular Weight: | 455 |
| Molecular Formula: | C25 H31 Cl N4 O2 |
| Smiles: | CCn1c2ccc(cc2nc1CN1CCCCCC1)NC(COc1ccc(c(C)c1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 5.7533 |
| logD: | 5.572 |
| logSw: | -5.8456 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 45.58 |
| InChI Key: | OJMADDDPGLIVDN-UHFFFAOYSA-N |