rel-(3aR,7aR)-5-benzyl-N-cyclohexyl-6-oxooctahydro-2H-pyrrolo[3,4-c]pyridine-2-carboxamide
Chemical Structure Depiction of
rel-(3aR,7aR)-5-benzyl-N-cyclohexyl-6-oxooctahydro-2H-pyrrolo[3,4-c]pyridine-2-carboxamide
rel-(3aR,7aR)-5-benzyl-N-cyclohexyl-6-oxooctahydro-2H-pyrrolo[3,4-c]pyridine-2-carboxamide
Compound characteristics
| Compound ID: | SB76-0330 |
| Compound Name: | rel-(3aR,7aR)-5-benzyl-N-cyclohexyl-6-oxooctahydro-2H-pyrrolo[3,4-c]pyridine-2-carboxamide |
| Molecular Weight: | 355.48 |
| Molecular Formula: | C21 H29 N3 O2 |
| Smiles: | [H][C@]12CC(N(Cc3ccccc3)C[C@]2([H])CN(C1)C(NC1CCCCC1)=O)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 3.0147 |
| logD: | 3.0147 |
| logSw: | -3.1277 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.546 |
| InChI Key: | NQCUUZAVWRSHLT-MSOLQXFVSA-N |