4-[(4-chloro-3-nitro-1H-pyrazol-1-yl)methyl]-N-{1-[(2-methylphenyl)methyl]-1H-pyrazol-4-yl}benzamide
Chemical Structure Depiction of
4-[(4-chloro-3-nitro-1H-pyrazol-1-yl)methyl]-N-{1-[(2-methylphenyl)methyl]-1H-pyrazol-4-yl}benzamide
4-[(4-chloro-3-nitro-1H-pyrazol-1-yl)methyl]-N-{1-[(2-methylphenyl)methyl]-1H-pyrazol-4-yl}benzamide
Compound characteristics
| Compound ID: | Y502-9534 |
| Compound Name: | 4-[(4-chloro-3-nitro-1H-pyrazol-1-yl)methyl]-N-{1-[(2-methylphenyl)methyl]-1H-pyrazol-4-yl}benzamide |
| Molecular Weight: | 450.88 |
| Molecular Formula: | C22 H19 Cl N6 O3 |
| Smiles: | Cc1ccccc1Cn1cc(cn1)NC(c1ccc(Cn2cc(c(n2)[N+]([O-])=O)[Cl])cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7298 |
| logD: | 3.7227 |
| logSw: | -4.1363 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 85.432 |
| InChI Key: | NKZLBAAVSCQWSV-UHFFFAOYSA-N |