N-(2,4-dimethylphenyl)-1-[(2-nitrophenoxy)methyl]-1H-pyrazole-3-carboxamide
Chemical Structure Depiction of
N-(2,4-dimethylphenyl)-1-[(2-nitrophenoxy)methyl]-1H-pyrazole-3-carboxamide
N-(2,4-dimethylphenyl)-1-[(2-nitrophenoxy)methyl]-1H-pyrazole-3-carboxamide
Compound characteristics
| Compound ID: | Y502-3927 |
| Compound Name: | N-(2,4-dimethylphenyl)-1-[(2-nitrophenoxy)methyl]-1H-pyrazole-3-carboxamide |
| Molecular Weight: | 366.37 |
| Molecular Formula: | C19 H18 N4 O4 |
| Smiles: | Cc1ccc(c(C)c1)NC(c1ccn(COc2ccccc2[N+]([O-])=O)n1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.614 |
| logD: | 3.614 |
| logSw: | -3.812 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.162 |
| InChI Key: | NHORYFGXHFZMBE-UHFFFAOYSA-N |