N-[(3-methoxyphenyl)methyl]-4-(4-nitro-1H-pyrazol-1-yl)butanamide
Chemical Structure Depiction of
N-[(3-methoxyphenyl)methyl]-4-(4-nitro-1H-pyrazol-1-yl)butanamide
N-[(3-methoxyphenyl)methyl]-4-(4-nitro-1H-pyrazol-1-yl)butanamide
Compound characteristics
| Compound ID: | 8017-9397 |
| Compound Name: | N-[(3-methoxyphenyl)methyl]-4-(4-nitro-1H-pyrazol-1-yl)butanamide |
| Molecular Weight: | 318.33 |
| Molecular Formula: | C15 H18 N4 O4 |
| Smiles: | COc1cccc(CNC(CCCn2cc(cn2)[N+]([O-])=O)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 0.8865 |
| logD: | 0.8865 |
| logSw: | -1.9809 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 80.119 |
| InChI Key: | PJJHVVSDOJQHDH-UHFFFAOYSA-N |