N-{2-[(azepan-1-yl)methyl]-1-propyl-1H-benzimidazol-5-yl}-2-phenoxyacetamide
Chemical Structure Depiction of
N-{2-[(azepan-1-yl)methyl]-1-propyl-1H-benzimidazol-5-yl}-2-phenoxyacetamide
N-{2-[(azepan-1-yl)methyl]-1-propyl-1H-benzimidazol-5-yl}-2-phenoxyacetamide
Compound characteristics
| Compound ID: | D332-0099 |
| Compound Name: | N-{2-[(azepan-1-yl)methyl]-1-propyl-1H-benzimidazol-5-yl}-2-phenoxyacetamide |
| Molecular Weight: | 420.55 |
| Molecular Formula: | C25 H32 N4 O2 |
| Smiles: | CCCn1c2ccc(cc2nc1CN1CCCCCC1)NC(COc1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.9028 |
| logD: | 4.3348 |
| logSw: | -4.5104 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 45.834 |
| InChI Key: | WOVSNVTXFBRPOI-UHFFFAOYSA-N |