rel-(3aR,7aS)-7a-[(dimethylamino)methyl]-N,N-dimethyl-5-(pyridine-3-sulfonyl)octahydro-2H-pyrrolo[3,4-c]pyridine-2-carboxamide
Chemical Structure Depiction of
rel-(3aR,7aS)-7a-[(dimethylamino)methyl]-N,N-dimethyl-5-(pyridine-3-sulfonyl)octahydro-2H-pyrrolo[3,4-c]pyridine-2-carboxamide
rel-(3aR,7aS)-7a-[(dimethylamino)methyl]-N,N-dimethyl-5-(pyridine-3-sulfonyl)octahydro-2H-pyrrolo[3,4-c]pyridine-2-carboxamide
Compound characteristics
| Compound ID: | CM2431B-6792 |
| Compound Name: | rel-(3aR,7aS)-7a-[(dimethylamino)methyl]-N,N-dimethyl-5-(pyridine-3-sulfonyl)octahydro-2H-pyrrolo[3,4-c]pyridine-2-carboxamide |
| Molecular Weight: | 395.52 |
| Molecular Formula: | C18 H29 N5 O3 S |
| Smiles: | CN(C)C[C@@]12CCN(C[C@H]2CN(C1)C(N(C)C)=O)S(c1cccnc1)(=O)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 0.2137 |
| logD: | -2.664 |
| logSw: | -1.4682 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 63.056 |
| InChI Key: | DYUKVPWXBJANTA-QAPCUYQASA-N |