N-{2-[(4-acetylpiperazin-1-yl)methyl]-1-methyl-1H-benzimidazol-5-yl}-3-bromobenzamide
Chemical Structure Depiction of
N-{2-[(4-acetylpiperazin-1-yl)methyl]-1-methyl-1H-benzimidazol-5-yl}-3-bromobenzamide
N-{2-[(4-acetylpiperazin-1-yl)methyl]-1-methyl-1H-benzimidazol-5-yl}-3-bromobenzamide
Compound characteristics
| Compound ID: | D044-0090 |
| Compound Name: | N-{2-[(4-acetylpiperazin-1-yl)methyl]-1-methyl-1H-benzimidazol-5-yl}-3-bromobenzamide |
| Molecular Weight: | 470.37 |
| Molecular Formula: | C22 H24 Br N5 O2 |
| Smiles: | CC(N1CCN(CC1)Cc1nc2cc(ccc2n1C)NC(c1cccc(c1)[Br])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7835 |
| logD: | 2.734 |
| logSw: | -3.2818 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.244 |
| InChI Key: | HLYABXCBGBTTLV-UHFFFAOYSA-N |