ethyl rel-(6R,7aS)-2-(butan-2-yl)-1-oxo-1,2,3,6,7,7a-hexahydro-3a,6-epoxyisoindole-7-carboxylate
Chemical Structure Depiction of
ethyl rel-(6R,7aS)-2-(butan-2-yl)-1-oxo-1,2,3,6,7,7a-hexahydro-3a,6-epoxyisoindole-7-carboxylate
ethyl rel-(6R,7aS)-2-(butan-2-yl)-1-oxo-1,2,3,6,7,7a-hexahydro-3a,6-epoxyisoindole-7-carboxylate
Compound characteristics
| Compound ID: | 6283-0243 |
| Compound Name: | ethyl rel-(6R,7aS)-2-(butan-2-yl)-1-oxo-1,2,3,6,7,7a-hexahydro-3a,6-epoxyisoindole-7-carboxylate |
| Molecular Weight: | 279.33 |
| Molecular Formula: | C15 H21 N O4 |
| Smiles: | CCC(C)N1C[C@]23C=C[C@H](C(C(=O)OCC)[C@@H]2C1=O)O3 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 1.9123 |
| logD: | 1.9123 |
| logSw: | -1.722 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 45.043 |
| InChI Key: | LSUPCXIJJZIUAD-MZOWXFEASA-N |