3-[(4-bromo-3-nitro-1H-pyrazol-1-yl)methyl]-N-(2-chlorophenyl)benzamide
Chemical Structure Depiction of
3-[(4-bromo-3-nitro-1H-pyrazol-1-yl)methyl]-N-(2-chlorophenyl)benzamide
3-[(4-bromo-3-nitro-1H-pyrazol-1-yl)methyl]-N-(2-chlorophenyl)benzamide
Compound characteristics
| Compound ID: | Y500-8373 |
| Compound Name: | 3-[(4-bromo-3-nitro-1H-pyrazol-1-yl)methyl]-N-(2-chlorophenyl)benzamide |
| Molecular Weight: | 435.66 |
| Molecular Formula: | C17 H12 Br Cl N4 O3 |
| Smiles: | C(c1cccc(c1)C(Nc1ccccc1[Cl])=O)n1cc(c(n1)[N+]([O-])=O)[Br] |
| Stereo: | ACHIRAL |
| logP: | 3.5203 |
| logD: | 3.5028 |
| logSw: | -3.7818 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.228 |
| InChI Key: | ODFYNUFXQHQOOB-UHFFFAOYSA-N |