4-(5-methyl-3-nitro-1H-pyrazol-1-yl)-N-{1-[(2-methylphenyl)methyl]-1H-pyrazol-4-yl}butanamide
Chemical Structure Depiction of
4-(5-methyl-3-nitro-1H-pyrazol-1-yl)-N-{1-[(2-methylphenyl)methyl]-1H-pyrazol-4-yl}butanamide
4-(5-methyl-3-nitro-1H-pyrazol-1-yl)-N-{1-[(2-methylphenyl)methyl]-1H-pyrazol-4-yl}butanamide
Compound characteristics
| Compound ID: | C163-0208 |
| Compound Name: | 4-(5-methyl-3-nitro-1H-pyrazol-1-yl)-N-{1-[(2-methylphenyl)methyl]-1H-pyrazol-4-yl}butanamide |
| Molecular Weight: | 382.42 |
| Molecular Formula: | C19 H22 N6 O3 |
| Smiles: | Cc1ccccc1Cn1cc(cn1)NC(CCCn1c(C)cc(n1)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.6976 |
| logD: | 1.6967 |
| logSw: | -2.3235 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 84.646 |
| InChI Key: | PXNXVUHFIDFHRI-UHFFFAOYSA-N |