N-(3,4-dimethoxyphenyl)-4-(5-methyl-3-nitro-1H-pyrazol-1-yl)butanamide
Chemical Structure Depiction of
N-(3,4-dimethoxyphenyl)-4-(5-methyl-3-nitro-1H-pyrazol-1-yl)butanamide
N-(3,4-dimethoxyphenyl)-4-(5-methyl-3-nitro-1H-pyrazol-1-yl)butanamide
Compound characteristics
| Compound ID: | C163-0131 |
| Compound Name: | N-(3,4-dimethoxyphenyl)-4-(5-methyl-3-nitro-1H-pyrazol-1-yl)butanamide |
| Molecular Weight: | 348.36 |
| Molecular Formula: | C16 H20 N4 O5 |
| Smiles: | Cc1cc(nn1CCCC(Nc1ccc(c(c1)OC)OC)=O)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 0.7063 |
| logD: | 0.7061 |
| logSw: | -2.1188 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 85.401 |
| InChI Key: | VNCSUUUITVNYPU-UHFFFAOYSA-N |