N-[3-(4-chlorophenoxy)-5-nitrophenyl]-2-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)acetamide
Chemical Structure Depiction of
N-[3-(4-chlorophenoxy)-5-nitrophenyl]-2-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)acetamide
N-[3-(4-chlorophenoxy)-5-nitrophenyl]-2-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)acetamide
Compound characteristics
| Compound ID: | Y501-7193 |
| Compound Name: | N-[3-(4-chlorophenoxy)-5-nitrophenyl]-2-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)acetamide |
| Molecular Weight: | 445.82 |
| Molecular Formula: | C19 H16 Cl N5 O6 |
| Smiles: | Cc1c(c(C)n(CC(Nc2cc(cc(c2)Oc2ccc(cc2)[Cl])[N+]([O-])=O)=O)n1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 4.1593 |
| logD: | 4.1581 |
| logSw: | -4.6948 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 110.578 |
| InChI Key: | FKVMSLPBAGOZPC-UHFFFAOYSA-N |