rel-(3aR,7aR)-2-benzyl-7a-(hydroxymethyl)-N,N-dimethyloctahydro-5H-pyrrolo[3,4-c]pyridine-5-carboxamide
Chemical Structure Depiction of
rel-(3aR,7aR)-2-benzyl-7a-(hydroxymethyl)-N,N-dimethyloctahydro-5H-pyrrolo[3,4-c]pyridine-5-carboxamide
rel-(3aR,7aR)-2-benzyl-7a-(hydroxymethyl)-N,N-dimethyloctahydro-5H-pyrrolo[3,4-c]pyridine-5-carboxamide
Compound characteristics
| Compound ID: | S997-0573 |
| Compound Name: | rel-(3aR,7aR)-2-benzyl-7a-(hydroxymethyl)-N,N-dimethyloctahydro-5H-pyrrolo[3,4-c]pyridine-5-carboxamide |
| Molecular Weight: | 317.43 |
| Molecular Formula: | C18 H27 N3 O2 |
| Smiles: | CN(C)C(N1CC[C@]2(CN(Cc3ccccc3)C[C@H]2C1)CO)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 1.3065 |
| logD: | -2.1426 |
| logSw: | -1.4286 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 38.787 |
| InChI Key: | PTLVBJPJDUGRGT-SJLPKXTDSA-N |