2-[3,5-dimethyl-1-(4-nitrophenyl)-1H-pyrazol-4-yl]-1H-isoindole-1,3(2H)-dione
Chemical Structure Depiction of
2-[3,5-dimethyl-1-(4-nitrophenyl)-1H-pyrazol-4-yl]-1H-isoindole-1,3(2H)-dione
2-[3,5-dimethyl-1-(4-nitrophenyl)-1H-pyrazol-4-yl]-1H-isoindole-1,3(2H)-dione
Compound characteristics
| Compound ID: | Y500-0235 |
| Compound Name: | 2-[3,5-dimethyl-1-(4-nitrophenyl)-1H-pyrazol-4-yl]-1H-isoindole-1,3(2H)-dione |
| Molecular Weight: | 362.34 |
| Molecular Formula: | C19 H14 N4 O4 |
| Smiles: | Cc1c(c(C)n(c2ccc(cc2)[N+]([O-])=O)n1)N1C(c2ccccc2C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8939 |
| logD: | 2.8939 |
| logSw: | -3.5274 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 76.077 |
| InChI Key: | ILJQWKQFMREFGM-UHFFFAOYSA-N |