ethyl rel-(1R,2S,3R,8aR)-3-benzoyl-2-phenyl-1-(tricyclo[3.3.1.1~3,7~]decane-1-carbonyl)-1,2,3,8a-tetrahydroindolizine-6-carboxylate
Chemical Structure Depiction of
ethyl rel-(1R,2S,3R,8aR)-3-benzoyl-2-phenyl-1-(tricyclo[3.3.1.1~3,7~]decane-1-carbonyl)-1,2,3,8a-tetrahydroindolizine-6-carboxylate
ethyl rel-(1R,2S,3R,8aR)-3-benzoyl-2-phenyl-1-(tricyclo[3.3.1.1~3,7~]decane-1-carbonyl)-1,2,3,8a-tetrahydroindolizine-6-carboxylate
Compound characteristics
| Compound ID: | 8005-2597 |
| Compound Name: | ethyl rel-(1R,2S,3R,8aR)-3-benzoyl-2-phenyl-1-(tricyclo[3.3.1.1~3,7~]decane-1-carbonyl)-1,2,3,8a-tetrahydroindolizine-6-carboxylate |
| Molecular Weight: | 535.68 |
| Molecular Formula: | C35 H37 N O4 |
| Smiles: | [H][C@]12C=CC(=CN2[C@H](C(c2ccccc2)=O)[C@@H](c2ccccc2)[C@@H]1C(C12CC3CC(CC(C3)C2)C1)=O)C(=O)OCC |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 7.0252 |
| logD: | 7.0252 |
| logSw: | -5.9474 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 50.893 |
| InChI Key: | MJZHJIOQXQPFOO-LJTZGBHQSA-N |