2-{rel-(3aR,7aS)-3a-(3-methyl-1,2,4-oxadiazol-5-yl)-5-[(pyridin-3-yl)methyl]octahydro-2H-pyrrolo[3,4-c]pyridin-2-yl}ethan-1-ol
Chemical Structure Depiction of
2-{rel-(3aR,7aS)-3a-(3-methyl-1,2,4-oxadiazol-5-yl)-5-[(pyridin-3-yl)methyl]octahydro-2H-pyrrolo[3,4-c]pyridin-2-yl}ethan-1-ol
2-{rel-(3aR,7aS)-3a-(3-methyl-1,2,4-oxadiazol-5-yl)-5-[(pyridin-3-yl)methyl]octahydro-2H-pyrrolo[3,4-c]pyridin-2-yl}ethan-1-ol
Compound characteristics
| Compound ID: | S839-0037 |
| Compound Name: | 2-{rel-(3aR,7aS)-3a-(3-methyl-1,2,4-oxadiazol-5-yl)-5-[(pyridin-3-yl)methyl]octahydro-2H-pyrrolo[3,4-c]pyridin-2-yl}ethan-1-ol |
| Molecular Weight: | 343.43 |
| Molecular Formula: | C18 H25 N5 O2 |
| Smiles: | Cc1nc([C@@]23CN(CC[C@H]3CN(CCO)C2)Cc2cccnc2)on1 |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 0.2111 |
| logD: | -2.7441 |
| logSw: | -0.3068 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.312 |
| InChI Key: | YNSHVAKQFJTOOQ-SJLPKXTDSA-N |