N-{2-[(azepan-1-yl)methyl]-1-ethyl-1H-benzimidazol-5-yl}-3-methylbutanamide
Chemical Structure Depiction of
N-{2-[(azepan-1-yl)methyl]-1-ethyl-1H-benzimidazol-5-yl}-3-methylbutanamide
N-{2-[(azepan-1-yl)methyl]-1-ethyl-1H-benzimidazol-5-yl}-3-methylbutanamide
Compound characteristics
| Compound ID: | D332-0006 |
| Compound Name: | N-{2-[(azepan-1-yl)methyl]-1-ethyl-1H-benzimidazol-5-yl}-3-methylbutanamide |
| Molecular Weight: | 356.51 |
| Molecular Formula: | C21 H32 N4 O |
| Smiles: | CCn1c2ccc(cc2nc1CN1CCCCCC1)NC(CC(C)C)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2378 |
| logD: | 4.0566 |
| logSw: | -3.997 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 38.353 |
| InChI Key: | SLMLNPOQJXGQFB-UHFFFAOYSA-N |