N-[2-(1H-benzimidazol-2-yl)ethyl]-4-(3-nitro-1H-pyrazol-1-yl)butanamide
Chemical Structure Depiction of
N-[2-(1H-benzimidazol-2-yl)ethyl]-4-(3-nitro-1H-pyrazol-1-yl)butanamide
N-[2-(1H-benzimidazol-2-yl)ethyl]-4-(3-nitro-1H-pyrazol-1-yl)butanamide
Compound characteristics
| Compound ID: | 8017-5228 |
| Compound Name: | N-[2-(1H-benzimidazol-2-yl)ethyl]-4-(3-nitro-1H-pyrazol-1-yl)butanamide |
| Molecular Weight: | 342.36 |
| Molecular Formula: | C16 H18 N6 O3 |
| Smiles: | C(CC(NCCc1nc2ccccc2[nH]1)=O)Cn1ccc(n1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 0.2473 |
| logD: | 0.2338 |
| logSw: | -1.8118 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 92.045 |
| InChI Key: | XAEOGHYBYYNTIQ-UHFFFAOYSA-N |