2-{1-[(4-chlorophenyl)methyl]-3,5-dimethyl-1H-pyrazol-4-yl}hexahydro-1H-4,7-epoxyisoindole-1,3(2H)-dione
Chemical Structure Depiction of
2-{1-[(4-chlorophenyl)methyl]-3,5-dimethyl-1H-pyrazol-4-yl}hexahydro-1H-4,7-epoxyisoindole-1,3(2H)-dione
2-{1-[(4-chlorophenyl)methyl]-3,5-dimethyl-1H-pyrazol-4-yl}hexahydro-1H-4,7-epoxyisoindole-1,3(2H)-dione
Compound characteristics
| Compound ID: | Y502-9513 |
| Compound Name: | 2-{1-[(4-chlorophenyl)methyl]-3,5-dimethyl-1H-pyrazol-4-yl}hexahydro-1H-4,7-epoxyisoindole-1,3(2H)-dione |
| Molecular Weight: | 385.85 |
| Molecular Formula: | C20 H20 Cl N3 O3 |
| Smiles: | Cc1c(c(C)n(Cc2ccc(cc2)[Cl])n1)N1C(C2C(C3CCC2O3)C1=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.1194 |
| logD: | 3.1194 |
| logSw: | -3.3936 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 51.184 |
| InChI Key: | OLXBKELCWNVUGG-UHFFFAOYSA-N |