N-[(1-methyl-1H-pyrazol-4-yl)methyl]-3-(3-nitro-1H-pyrazol-1-yl)propanamide
Chemical Structure Depiction of
N-[(1-methyl-1H-pyrazol-4-yl)methyl]-3-(3-nitro-1H-pyrazol-1-yl)propanamide
N-[(1-methyl-1H-pyrazol-4-yl)methyl]-3-(3-nitro-1H-pyrazol-1-yl)propanamide
Compound characteristics
| Compound ID: | Y500-2181 |
| Compound Name: | N-[(1-methyl-1H-pyrazol-4-yl)methyl]-3-(3-nitro-1H-pyrazol-1-yl)propanamide |
| Molecular Weight: | 278.27 |
| Molecular Formula: | C11 H14 N6 O3 |
| Smiles: | Cn1cc(CNC(CCn2ccc(n2)[N+]([O-])=O)=O)cn1 |
| Stereo: | ACHIRAL |
| logP: | -0.8797 |
| logD: | -0.8797 |
| logSw: | -1.5846 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 86.731 |
| InChI Key: | BAGCTIXQMYRHFO-UHFFFAOYSA-N |