rel-(3aR,7aS)-5-benzyl-2-[(3,5-dimethyl-1,2-oxazol-4-yl)acetyl]octahydro-6H-pyrrolo[3,4-c]pyridin-6-one
Chemical Structure Depiction of
rel-(3aR,7aS)-5-benzyl-2-[(3,5-dimethyl-1,2-oxazol-4-yl)acetyl]octahydro-6H-pyrrolo[3,4-c]pyridin-6-one
rel-(3aR,7aS)-5-benzyl-2-[(3,5-dimethyl-1,2-oxazol-4-yl)acetyl]octahydro-6H-pyrrolo[3,4-c]pyridin-6-one
Compound characteristics
| Compound ID: | SB76-0397 |
| Compound Name: | rel-(3aR,7aS)-5-benzyl-2-[(3,5-dimethyl-1,2-oxazol-4-yl)acetyl]octahydro-6H-pyrrolo[3,4-c]pyridin-6-one |
| Molecular Weight: | 367.45 |
| Molecular Formula: | C21 H25 N3 O3 |
| Smiles: | [H][C@@]12CN(Cc3ccccc3)C(C[C@@]2([H])CN(C1)C(Cc1c(C)noc1C)=O)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 1.7174 |
| logD: | 1.7174 |
| logSw: | -1.8357 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 55.188 |
| InChI Key: | WCDPALNHYWFCGM-MSOLQXFVSA-N |