2-(4-bromo-5-methyl-3-nitro-1H-pyrazol-1-yl)-N-[(3,4-dimethoxyphenyl)methyl]acetamide
Chemical Structure Depiction of
2-(4-bromo-5-methyl-3-nitro-1H-pyrazol-1-yl)-N-[(3,4-dimethoxyphenyl)methyl]acetamide
2-(4-bromo-5-methyl-3-nitro-1H-pyrazol-1-yl)-N-[(3,4-dimethoxyphenyl)methyl]acetamide
Compound characteristics
| Compound ID: | 8017-0453 |
| Compound Name: | 2-(4-bromo-5-methyl-3-nitro-1H-pyrazol-1-yl)-N-[(3,4-dimethoxyphenyl)methyl]acetamide |
| Molecular Weight: | 413.23 |
| Molecular Formula: | C15 H17 Br N4 O5 |
| Smiles: | Cc1c(c(nn1CC(NCc1ccc(c(c1)OC)OC)=O)[N+]([O-])=O)[Br] |
| Stereo: | ACHIRAL |
| logP: | 1.4001 |
| logD: | 1.4001 |
| logSw: | -2.4552 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 86.99 |
| InChI Key: | KPLHQEMDMAIABO-UHFFFAOYSA-N |