N-[2-(3,4-dimethoxyphenyl)ethyl]-2-(5-methyl-3-nitro-1H-pyrazol-1-yl)acetamide
Chemical Structure Depiction of
N-[2-(3,4-dimethoxyphenyl)ethyl]-2-(5-methyl-3-nitro-1H-pyrazol-1-yl)acetamide
N-[2-(3,4-dimethoxyphenyl)ethyl]-2-(5-methyl-3-nitro-1H-pyrazol-1-yl)acetamide
Compound characteristics
| Compound ID: | Y500-0558 |
| Compound Name: | N-[2-(3,4-dimethoxyphenyl)ethyl]-2-(5-methyl-3-nitro-1H-pyrazol-1-yl)acetamide |
| Molecular Weight: | 348.36 |
| Molecular Formula: | C16 H20 N4 O5 |
| Smiles: | Cc1cc(nn1CC(NCCc1ccc(c(c1)OC)OC)=O)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 0.3103 |
| logD: | 0.3103 |
| logSw: | -2.189 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 86.586 |
| InChI Key: | BPNAAATYQLWSFI-UHFFFAOYSA-N |