1-{4-[(1-methyl-5-nitro-1H-benzimidazol-2-yl)methyl]piperazin-1-yl}ethan-1-one
Chemical Structure Depiction of
1-{4-[(1-methyl-5-nitro-1H-benzimidazol-2-yl)methyl]piperazin-1-yl}ethan-1-one
1-{4-[(1-methyl-5-nitro-1H-benzimidazol-2-yl)methyl]piperazin-1-yl}ethan-1-one
Compound characteristics
| Compound ID: | 8016-2401 |
| Compound Name: | 1-{4-[(1-methyl-5-nitro-1H-benzimidazol-2-yl)methyl]piperazin-1-yl}ethan-1-one |
| Molecular Weight: | 317.35 |
| Molecular Formula: | C15 H19 N5 O3 |
| Smiles: | CC(N1CCN(CC1)Cc1nc2cc(ccc2n1C)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.9239 |
| logD: | 0.9192 |
| logSw: | -2.0435 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 66.535 |
| InChI Key: | BXKZJUCKNGLAOH-UHFFFAOYSA-N |