2-(3-bromo-4-methylphenyl)-4-(hydroxymethyl)-3a,4,7,7a-tetrahydro-1H-4,7-epoxyisoindole-1,3(2H)-dione
Chemical Structure Depiction of
2-(3-bromo-4-methylphenyl)-4-(hydroxymethyl)-3a,4,7,7a-tetrahydro-1H-4,7-epoxyisoindole-1,3(2H)-dione
2-(3-bromo-4-methylphenyl)-4-(hydroxymethyl)-3a,4,7,7a-tetrahydro-1H-4,7-epoxyisoindole-1,3(2H)-dione
Compound characteristics
| Compound ID: | 1935-0139 |
| Compound Name: | 2-(3-bromo-4-methylphenyl)-4-(hydroxymethyl)-3a,4,7,7a-tetrahydro-1H-4,7-epoxyisoindole-1,3(2H)-dione |
| Molecular Weight: | 364.19 |
| Molecular Formula: | C16 H14 Br N O4 |
| Smiles: | Cc1ccc(cc1[Br])N1C(C2C(C1=O)C1(CO)C=CC2O1)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 1.6982 |
| logD: | 1.6982 |
| logSw: | -1.9826 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.111 |
| InChI Key: | RSJFUECLXYFTIV-UHFFFAOYSA-N |