4-nitro-N-{2-[(piperidin-1-yl)methyl]-1-propyl-1H-benzimidazol-5-yl}benzamide
Chemical Structure Depiction of
4-nitro-N-{2-[(piperidin-1-yl)methyl]-1-propyl-1H-benzimidazol-5-yl}benzamide
4-nitro-N-{2-[(piperidin-1-yl)methyl]-1-propyl-1H-benzimidazol-5-yl}benzamide
Compound characteristics
| Compound ID: | D305-1325 |
| Compound Name: | 4-nitro-N-{2-[(piperidin-1-yl)methyl]-1-propyl-1H-benzimidazol-5-yl}benzamide |
| Molecular Weight: | 421.5 |
| Molecular Formula: | C23 H27 N5 O3 |
| Smiles: | CCCn1c2ccc(cc2nc1CN1CCCCC1)NC(c1ccc(cc1)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3268 |
| logD: | 3.74 |
| logSw: | -4.1299 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.599 |
| InChI Key: | BRJGTWHQUZWMOH-UHFFFAOYSA-N |