rel-(4R,7S)-2-(2-methylphenyl)-3a,4,7,7a-tetrahydro-1H-4,7-epoxyisoindole-1,3(2H)-dione
Chemical Structure Depiction of
rel-(4R,7S)-2-(2-methylphenyl)-3a,4,7,7a-tetrahydro-1H-4,7-epoxyisoindole-1,3(2H)-dione
rel-(4R,7S)-2-(2-methylphenyl)-3a,4,7,7a-tetrahydro-1H-4,7-epoxyisoindole-1,3(2H)-dione
Compound characteristics
| Compound ID: | 8003-2925 |
| Compound Name: | rel-(4R,7S)-2-(2-methylphenyl)-3a,4,7,7a-tetrahydro-1H-4,7-epoxyisoindole-1,3(2H)-dione |
| Molecular Weight: | 255.27 |
| Molecular Formula: | C15 H13 N O3 |
| Smiles: | Cc1ccccc1N1C(C2C(C1=O)[C@H]1C=C[C@@H]2O1)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 1.3097 |
| logD: | 1.3097 |
| logSw: | -1.684 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 37.203 |
| InChI Key: | SIWQWWDYLADSCY-UHFFFAOYSA-N |