2-(4-chloro-1H-pyrazol-1-yl)-N-[3-nitro-5-(2,3,5-trimethylphenoxy)phenyl]butanamide
Chemical Structure Depiction of
2-(4-chloro-1H-pyrazol-1-yl)-N-[3-nitro-5-(2,3,5-trimethylphenoxy)phenyl]butanamide
2-(4-chloro-1H-pyrazol-1-yl)-N-[3-nitro-5-(2,3,5-trimethylphenoxy)phenyl]butanamide
Compound characteristics
| Compound ID: | Y501-5649 |
| Compound Name: | 2-(4-chloro-1H-pyrazol-1-yl)-N-[3-nitro-5-(2,3,5-trimethylphenoxy)phenyl]butanamide |
| Molecular Weight: | 442.9 |
| Molecular Formula: | C22 H23 Cl N4 O4 |
| Smiles: | CCC(C(Nc1cc(cc(c1)Oc1cc(C)cc(C)c1C)[N+]([O-])=O)=O)n1cc(cn1)[Cl] |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.8653 |
| logD: | 5.863 |
| logSw: | -5.8984 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.712 |
| InChI Key: | JAZOOGMNEJBVAY-FQEVSTJZSA-N |