4-(4-chloro-5-methyl-3-nitro-1H-pyrazol-1-yl)-N-[4-(trifluoromethoxy)phenyl]butanamide
Chemical Structure Depiction of
4-(4-chloro-5-methyl-3-nitro-1H-pyrazol-1-yl)-N-[4-(trifluoromethoxy)phenyl]butanamide
4-(4-chloro-5-methyl-3-nitro-1H-pyrazol-1-yl)-N-[4-(trifluoromethoxy)phenyl]butanamide
Compound characteristics
| Compound ID: | C163-0031 |
| Compound Name: | 4-(4-chloro-5-methyl-3-nitro-1H-pyrazol-1-yl)-N-[4-(trifluoromethoxy)phenyl]butanamide |
| Molecular Weight: | 406.75 |
| Molecular Formula: | C15 H14 Cl F3 N4 O4 |
| Smiles: | Cc1c(c(nn1CCCC(Nc1ccc(cc1)OC(F)(F)F)=O)[N+]([O-])=O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 3.08 |
| logD: | 3.08 |
| logSw: | -4.0669 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.322 |
| InChI Key: | KMJFMYYSKYTNFP-UHFFFAOYSA-N |