N-[2-(1H-benzimidazol-2-yl)ethyl]-1-methyl-3-nitro-1H-pyrazole-5-carboxamide
Chemical Structure Depiction of
N-[2-(1H-benzimidazol-2-yl)ethyl]-1-methyl-3-nitro-1H-pyrazole-5-carboxamide
N-[2-(1H-benzimidazol-2-yl)ethyl]-1-methyl-3-nitro-1H-pyrazole-5-carboxamide
Compound characteristics
| Compound ID: | 8017-7763 |
| Compound Name: | N-[2-(1H-benzimidazol-2-yl)ethyl]-1-methyl-3-nitro-1H-pyrazole-5-carboxamide |
| Molecular Weight: | 314.3 |
| Molecular Formula: | C14 H14 N6 O3 |
| Smiles: | Cn1c(cc(n1)[N+]([O-])=O)C(NCCc1nc2ccccc2[nH]1)=O |
| Stereo: | ACHIRAL |
| logP: | 0.8943 |
| logD: | 0.8937 |
| logSw: | -2.1448 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 91.136 |
| InChI Key: | ORKWEZXLZOFSOE-UHFFFAOYSA-N |