N-{2-[(azepan-1-yl)methyl]-1-methyl-1H-benzimidazol-5-yl}-2-phenoxyacetamide
Chemical Structure Depiction of
N-{2-[(azepan-1-yl)methyl]-1-methyl-1H-benzimidazol-5-yl}-2-phenoxyacetamide
N-{2-[(azepan-1-yl)methyl]-1-methyl-1H-benzimidazol-5-yl}-2-phenoxyacetamide
Compound characteristics
| Compound ID: | D332-0063 |
| Compound Name: | N-{2-[(azepan-1-yl)methyl]-1-methyl-1H-benzimidazol-5-yl}-2-phenoxyacetamide |
| Molecular Weight: | 392.5 |
| Molecular Formula: | C23 H28 N4 O2 |
| Smiles: | Cn1c2ccc(cc2nc1CN1CCCCCC1)NC(COc1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8058 |
| logD: | 3.536 |
| logSw: | -3.8325 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.665 |
| InChI Key: | MPLQRUKHEYZZMH-UHFFFAOYSA-N |