N-{1-butyl-2-[(2-methyl-1H-imidazol-1-yl)methyl]-1H-benzimidazol-5-yl}-2-nitrobenzamide
Chemical Structure Depiction of
N-{1-butyl-2-[(2-methyl-1H-imidazol-1-yl)methyl]-1H-benzimidazol-5-yl}-2-nitrobenzamide
N-{1-butyl-2-[(2-methyl-1H-imidazol-1-yl)methyl]-1H-benzimidazol-5-yl}-2-nitrobenzamide
Compound characteristics
| Compound ID: | D305-2398 |
| Compound Name: | N-{1-butyl-2-[(2-methyl-1H-imidazol-1-yl)methyl]-1H-benzimidazol-5-yl}-2-nitrobenzamide |
| Molecular Weight: | 432.48 |
| Molecular Formula: | C23 H24 N6 O3 |
| Smiles: | CCCCn1c2ccc(cc2nc1Cn1ccnc1C)NC(c1ccccc1[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5512 |
| logD: | 0.465 |
| logSw: | -3.8538 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.852 |
| InChI Key: | BOODXNDNNGEFGD-UHFFFAOYSA-N |