N-{3-bromo-1-[(4-chlorophenyl)methyl]-1H-pyrazol-4-yl}-2-(4-chloro-5-methyl-3-nitro-1H-pyrazol-1-yl)acetamide
Chemical Structure Depiction of
N-{3-bromo-1-[(4-chlorophenyl)methyl]-1H-pyrazol-4-yl}-2-(4-chloro-5-methyl-3-nitro-1H-pyrazol-1-yl)acetamide
N-{3-bromo-1-[(4-chlorophenyl)methyl]-1H-pyrazol-4-yl}-2-(4-chloro-5-methyl-3-nitro-1H-pyrazol-1-yl)acetamide
Compound characteristics
| Compound ID: | Y500-5727 |
| Compound Name: | N-{3-bromo-1-[(4-chlorophenyl)methyl]-1H-pyrazol-4-yl}-2-(4-chloro-5-methyl-3-nitro-1H-pyrazol-1-yl)acetamide |
| Molecular Weight: | 488.13 |
| Molecular Formula: | C16 H13 Br Cl2 N6 O3 |
| Smiles: | Cc1c(c(nn1CC(Nc1cn(Cc2ccc(cc2)[Cl])nc1[Br])=O)[N+]([O-])=O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 2.9497 |
| logD: | 2.9469 |
| logSw: | -3.769 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 85.112 |
| InChI Key: | NJPQKJLZIAUTCN-UHFFFAOYSA-N |