N-{1-methyl-2-[(4-propanoylpiperazin-1-yl)methyl]-1H-benzimidazol-5-yl}-2-(4-nitrophenoxy)acetamide
Chemical Structure Depiction of
N-{1-methyl-2-[(4-propanoylpiperazin-1-yl)methyl]-1H-benzimidazol-5-yl}-2-(4-nitrophenoxy)acetamide
N-{1-methyl-2-[(4-propanoylpiperazin-1-yl)methyl]-1H-benzimidazol-5-yl}-2-(4-nitrophenoxy)acetamide
Compound characteristics
| Compound ID: | D305-0782 |
| Compound Name: | N-{1-methyl-2-[(4-propanoylpiperazin-1-yl)methyl]-1H-benzimidazol-5-yl}-2-(4-nitrophenoxy)acetamide |
| Molecular Weight: | 480.52 |
| Molecular Formula: | C24 H28 N6 O5 |
| Smiles: | CCC(N1CCN(CC1)Cc1nc2cc(ccc2n1C)NC(COc1ccc(cc1)[N+]([O-])=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.2556 |
| logD: | 1.6614 |
| logSw: | -2.9902 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 95.916 |
| InChI Key: | MFJRIHQFOBQFFT-UHFFFAOYSA-N |