N-[2-(1H-benzimidazol-2-yl)ethyl]-4-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)butanamide
Chemical Structure Depiction of
N-[2-(1H-benzimidazol-2-yl)ethyl]-4-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)butanamide
N-[2-(1H-benzimidazol-2-yl)ethyl]-4-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)butanamide
Compound characteristics
| Compound ID: | 8017-5227 |
| Compound Name: | N-[2-(1H-benzimidazol-2-yl)ethyl]-4-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)butanamide |
| Molecular Weight: | 370.41 |
| Molecular Formula: | C18 H22 N6 O3 |
| Smiles: | Cc1c(c(C)n(CCCC(NCCc2nc3ccccc3[nH]2)=O)n1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 0.7832 |
| logD: | 0.7697 |
| logSw: | -1.9706 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 91.873 |
| InChI Key: | OBKFPDRWNIALQD-UHFFFAOYSA-N |