N-[3-(4-chlorophenoxy)-5-nitrophenyl]-3,5-dimethyl-1-phenyl-1H-pyrazole-4-carboxamide
Chemical Structure Depiction of
N-[3-(4-chlorophenoxy)-5-nitrophenyl]-3,5-dimethyl-1-phenyl-1H-pyrazole-4-carboxamide
N-[3-(4-chlorophenoxy)-5-nitrophenyl]-3,5-dimethyl-1-phenyl-1H-pyrazole-4-carboxamide
Compound characteristics
| Compound ID: | Y501-8208 |
| Compound Name: | N-[3-(4-chlorophenoxy)-5-nitrophenyl]-3,5-dimethyl-1-phenyl-1H-pyrazole-4-carboxamide |
| Molecular Weight: | 462.89 |
| Molecular Formula: | C24 H19 Cl N4 O4 |
| Smiles: | Cc1c(C(Nc2cc(cc(c2)Oc2ccc(cc2)[Cl])[N+]([O-])=O)=O)c(C)n(c2ccccc2)n1 |
| Stereo: | ACHIRAL |
| logP: | 5.6495 |
| logD: | 5.6005 |
| logSw: | -6.1441 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.877 |
| InChI Key: | PXNGAHHJIFUZIY-UHFFFAOYSA-N |