3-[(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)methyl]-N-{4-[(1H-pyrazol-1-yl)methyl]phenyl}benzamide
Chemical Structure Depiction of
3-[(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)methyl]-N-{4-[(1H-pyrazol-1-yl)methyl]phenyl}benzamide
3-[(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)methyl]-N-{4-[(1H-pyrazol-1-yl)methyl]phenyl}benzamide
Compound characteristics
| Compound ID: | Y501-7818 |
| Compound Name: | 3-[(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)methyl]-N-{4-[(1H-pyrazol-1-yl)methyl]phenyl}benzamide |
| Molecular Weight: | 430.47 |
| Molecular Formula: | C23 H22 N6 O3 |
| Smiles: | Cc1c(c(C)n(Cc2cccc(c2)C(Nc2ccc(Cn3cccn3)cc2)=O)n1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 2.4801 |
| logD: | 2.4798 |
| logSw: | -2.8941 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 84.914 |
| InChI Key: | RUUUCQBQCVZCDT-UHFFFAOYSA-N |