2-(4-chloro-5-methyl-3-nitro-1H-pyrazol-1-yl)-N-{1-[(4-methylphenyl)methyl]-1H-pyrazol-3-yl}acetamide
Chemical Structure Depiction of
2-(4-chloro-5-methyl-3-nitro-1H-pyrazol-1-yl)-N-{1-[(4-methylphenyl)methyl]-1H-pyrazol-3-yl}acetamide
2-(4-chloro-5-methyl-3-nitro-1H-pyrazol-1-yl)-N-{1-[(4-methylphenyl)methyl]-1H-pyrazol-3-yl}acetamide
Compound characteristics
| Compound ID: | Y500-5717 |
| Compound Name: | 2-(4-chloro-5-methyl-3-nitro-1H-pyrazol-1-yl)-N-{1-[(4-methylphenyl)methyl]-1H-pyrazol-3-yl}acetamide |
| Molecular Weight: | 388.81 |
| Molecular Formula: | C17 H17 Cl N6 O3 |
| Smiles: | Cc1ccc(Cn2ccc(NC(Cn3c(C)c(c(n3)[N+]([O-])=O)[Cl])=O)n2)cc1 |
| Stereo: | ACHIRAL |
| logP: | 2.4485 |
| logD: | 2.4471 |
| logSw: | -3.5495 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 85.363 |
| InChI Key: | UNLNFTDKGQECNR-UHFFFAOYSA-N |