2-(4-bromo-5-methyl-3-nitro-1H-pyrazol-1-yl)-N-(4-cyanophenyl)acetamide
Chemical Structure Depiction of
2-(4-bromo-5-methyl-3-nitro-1H-pyrazol-1-yl)-N-(4-cyanophenyl)acetamide
2-(4-bromo-5-methyl-3-nitro-1H-pyrazol-1-yl)-N-(4-cyanophenyl)acetamide
Compound characteristics
| Compound ID: | 8016-8456 |
| Compound Name: | 2-(4-bromo-5-methyl-3-nitro-1H-pyrazol-1-yl)-N-(4-cyanophenyl)acetamide |
| Molecular Weight: | 364.16 |
| Molecular Formula: | C13 H10 Br N5 O3 |
| Smiles: | Cc1c(c(nn1CC(Nc1ccc(C#N)cc1)=O)[N+]([O-])=O)[Br] |
| Stereo: | ACHIRAL |
| logP: | 1.8618 |
| logD: | 1.8612 |
| logSw: | -2.5564 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 87.463 |
| InChI Key: | ZNYONQMZSHFBPU-UHFFFAOYSA-N |