2-{1-[(4-chlorophenyl)methyl]-1H-pyrazol-4-yl}-4,5-dimethoxy-1H-isoindole-1,3(2H)-dione
Chemical Structure Depiction of
2-{1-[(4-chlorophenyl)methyl]-1H-pyrazol-4-yl}-4,5-dimethoxy-1H-isoindole-1,3(2H)-dione
2-{1-[(4-chlorophenyl)methyl]-1H-pyrazol-4-yl}-4,5-dimethoxy-1H-isoindole-1,3(2H)-dione
Compound characteristics
| Compound ID: | Y500-7264 |
| Compound Name: | 2-{1-[(4-chlorophenyl)methyl]-1H-pyrazol-4-yl}-4,5-dimethoxy-1H-isoindole-1,3(2H)-dione |
| Molecular Weight: | 397.82 |
| Molecular Formula: | C20 H16 Cl N3 O4 |
| Smiles: | COc1ccc2C(N(C(c2c1OC)=O)c1cnn(Cc2ccc(cc2)[Cl])c1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3167 |
| logD: | 2.3167 |
| logSw: | -3.3987 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 58.733 |
| InChI Key: | VLYKKKXUKJIIAM-UHFFFAOYSA-N |