N-{1-ethyl-2-[(pyrrolidin-1-yl)methyl]-1H-benzimidazol-5-yl}-2-(4-nitrophenoxy)acetamide
Chemical Structure Depiction of
N-{1-ethyl-2-[(pyrrolidin-1-yl)methyl]-1H-benzimidazol-5-yl}-2-(4-nitrophenoxy)acetamide
N-{1-ethyl-2-[(pyrrolidin-1-yl)methyl]-1H-benzimidazol-5-yl}-2-(4-nitrophenoxy)acetamide
Compound characteristics
| Compound ID: | D305-1769 |
| Compound Name: | N-{1-ethyl-2-[(pyrrolidin-1-yl)methyl]-1H-benzimidazol-5-yl}-2-(4-nitrophenoxy)acetamide |
| Molecular Weight: | 423.47 |
| Molecular Formula: | C22 H25 N5 O4 |
| Smiles: | CCn1c2ccc(cc2nc1CN1CCCC1)NC(COc1ccc(cc1)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5234 |
| logD: | 3.125 |
| logSw: | -3.711 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.997 |
| InChI Key: | GVDUYIJSKRTZLF-UHFFFAOYSA-N |