2-(4-chloro-5-methyl-3-nitro-1H-pyrazol-1-yl)-N-{1-[(2,4-dichlorophenyl)methyl]-1H-pyrazol-4-yl}acetamide
Chemical Structure Depiction of
2-(4-chloro-5-methyl-3-nitro-1H-pyrazol-1-yl)-N-{1-[(2,4-dichlorophenyl)methyl]-1H-pyrazol-4-yl}acetamide
2-(4-chloro-5-methyl-3-nitro-1H-pyrazol-1-yl)-N-{1-[(2,4-dichlorophenyl)methyl]-1H-pyrazol-4-yl}acetamide
Compound characteristics
| Compound ID: | Y500-5767 |
| Compound Name: | 2-(4-chloro-5-methyl-3-nitro-1H-pyrazol-1-yl)-N-{1-[(2,4-dichlorophenyl)methyl]-1H-pyrazol-4-yl}acetamide |
| Molecular Weight: | 443.67 |
| Molecular Formula: | C16 H13 Cl3 N6 O3 |
| Smiles: | Cc1c(c(nn1CC(Nc1cnn(Cc2ccc(cc2[Cl])[Cl])c1)=O)[N+]([O-])=O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 3.2991 |
| logD: | 3.2988 |
| logSw: | -3.8664 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 84.913 |
| InChI Key: | TYOBQUNTWCVIKQ-UHFFFAOYSA-N |