2-(1-benzyl-3,5-dimethyl-1H-pyrazol-4-yl)hexahydro-1H-4,7-epoxyisoindole-1,3(2H)-dione
Chemical Structure Depiction of
2-(1-benzyl-3,5-dimethyl-1H-pyrazol-4-yl)hexahydro-1H-4,7-epoxyisoindole-1,3(2H)-dione
2-(1-benzyl-3,5-dimethyl-1H-pyrazol-4-yl)hexahydro-1H-4,7-epoxyisoindole-1,3(2H)-dione
Compound characteristics
| Compound ID: | Y502-9517 |
| Compound Name: | 2-(1-benzyl-3,5-dimethyl-1H-pyrazol-4-yl)hexahydro-1H-4,7-epoxyisoindole-1,3(2H)-dione |
| Molecular Weight: | 351.4 |
| Molecular Formula: | C20 H21 N3 O3 |
| Smiles: | Cc1c(c(C)n(Cc2ccccc2)n1)N1C(C2C(C3CCC2O3)C1=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.5247 |
| logD: | 2.5247 |
| logSw: | -2.3295 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 51.184 |
| InChI Key: | ABVNLHFYPDEWBE-UHFFFAOYSA-N |