2-{1-[(4-bromophenoxy)methyl]-1H-pyrazol-4-yl}hexahydro-1H-4,7-epoxyisoindole-1,3(2H)-dione
Chemical Structure Depiction of
2-{1-[(4-bromophenoxy)methyl]-1H-pyrazol-4-yl}hexahydro-1H-4,7-epoxyisoindole-1,3(2H)-dione
2-{1-[(4-bromophenoxy)methyl]-1H-pyrazol-4-yl}hexahydro-1H-4,7-epoxyisoindole-1,3(2H)-dione
Compound characteristics
| Compound ID: | Y503-1737 |
| Compound Name: | 2-{1-[(4-bromophenoxy)methyl]-1H-pyrazol-4-yl}hexahydro-1H-4,7-epoxyisoindole-1,3(2H)-dione |
| Molecular Weight: | 418.24 |
| Molecular Formula: | C18 H16 Br N3 O4 |
| Smiles: | C1CC2C3C(C1O2)C(N(C3=O)c1cnn(COc2ccc(cc2)[Br])c1)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.352 |
| logD: | 3.352 |
| logSw: | -3.2834 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 59.984 |
| InChI Key: | GVJCZPYNNCJCNC-UHFFFAOYSA-N |