rel-(3aR,7aR)-6-oxo-N-(2-phenylethyl)octahydro-2H-pyrrolo[3,4-c]pyridine-2-carboxamide
Chemical Structure Depiction of
rel-(3aR,7aR)-6-oxo-N-(2-phenylethyl)octahydro-2H-pyrrolo[3,4-c]pyridine-2-carboxamide
rel-(3aR,7aR)-6-oxo-N-(2-phenylethyl)octahydro-2H-pyrrolo[3,4-c]pyridine-2-carboxamide
Compound characteristics
| Compound ID: | SB76-0502 |
| Compound Name: | rel-(3aR,7aR)-6-oxo-N-(2-phenylethyl)octahydro-2H-pyrrolo[3,4-c]pyridine-2-carboxamide |
| Molecular Weight: | 287.36 |
| Molecular Formula: | C16 H21 N3 O2 |
| Smiles: | [H][C@]12CC(NC[C@]2([H])CN(C1)C(NCCc1ccccc1)=O)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 0.7688 |
| logD: | 0.7688 |
| logSw: | -1.6745 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 51.979 |
| InChI Key: | KAEHDWDFBVGAPI-KGLIPLIRSA-N |