rel-(4R,7S)-3a,4,7,7a-tetrahydro-1H-4,7-methanoisoindole-1,3(2H)-dione
Chemical Structure Depiction of
rel-(4R,7S)-3a,4,7,7a-tetrahydro-1H-4,7-methanoisoindole-1,3(2H)-dione
rel-(4R,7S)-3a,4,7,7a-tetrahydro-1H-4,7-methanoisoindole-1,3(2H)-dione
Compound characteristics
| Compound ID: | 4483-1411 |
| Compound Name: | rel-(4R,7S)-3a,4,7,7a-tetrahydro-1H-4,7-methanoisoindole-1,3(2H)-dione |
| Molecular Weight: | 163.17 |
| Molecular Formula: | C9 H9 N O2 |
| Smiles: | C1[C@H]2C=C[C@@H]1C1C2C(NC1=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 0.4049 |
| logD: | -0.4216 |
| logSw: | -1.4719 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 39.849 |
| InChI Key: | GPIUUMROPXDNRH-DPTVFECHSA-N |