N-(4-chloro-2,5-dimethoxyphenyl)-4-(4-chloro-5-methyl-3-nitro-1H-pyrazol-1-yl)butanamide
Chemical Structure Depiction of
N-(4-chloro-2,5-dimethoxyphenyl)-4-(4-chloro-5-methyl-3-nitro-1H-pyrazol-1-yl)butanamide
N-(4-chloro-2,5-dimethoxyphenyl)-4-(4-chloro-5-methyl-3-nitro-1H-pyrazol-1-yl)butanamide
Compound characteristics
| Compound ID: | C163-0041 |
| Compound Name: | N-(4-chloro-2,5-dimethoxyphenyl)-4-(4-chloro-5-methyl-3-nitro-1H-pyrazol-1-yl)butanamide |
| Molecular Weight: | 417.25 |
| Molecular Formula: | C16 H18 Cl2 N4 O5 |
| Smiles: | Cc1c(c(nn1CCCC(Nc1cc(c(cc1OC)[Cl])OC)=O)[N+]([O-])=O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 2.1775 |
| logD: | 2.0394 |
| logSw: | -3.5136 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 84.949 |
| InChI Key: | RUSVJAWDKBEEDC-UHFFFAOYSA-N |