N-{1-methyl-2-[(4-methylpiperazin-1-yl)methyl]-1H-benzimidazol-5-yl}-2-(4-nitrophenoxy)acetamide
Chemical Structure Depiction of
N-{1-methyl-2-[(4-methylpiperazin-1-yl)methyl]-1H-benzimidazol-5-yl}-2-(4-nitrophenoxy)acetamide
N-{1-methyl-2-[(4-methylpiperazin-1-yl)methyl]-1H-benzimidazol-5-yl}-2-(4-nitrophenoxy)acetamide
Compound characteristics
| Compound ID: | D305-0032 |
| Compound Name: | N-{1-methyl-2-[(4-methylpiperazin-1-yl)methyl]-1H-benzimidazol-5-yl}-2-(4-nitrophenoxy)acetamide |
| Molecular Weight: | 438.49 |
| Molecular Formula: | C22 H26 N6 O4 |
| Smiles: | CN1CCN(CC1)Cc1nc2cc(ccc2n1C)NC(COc1ccc(cc1)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.0704 |
| logD: | 1.0994 |
| logSw: | -2.9818 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 83.192 |
| InChI Key: | YSJMFROJTJOIGW-UHFFFAOYSA-N |