[rel-(3aR,7aS)-3a-(3-methyl-1,2,4-oxadiazol-5-yl)tetrahydro-1H-pyrrolo[3,4-c]pyridine-2,5(3H,4H)-diyl]bis(phenylmethanone)
Chemical Structure Depiction of
[rel-(3aR,7aS)-3a-(3-methyl-1,2,4-oxadiazol-5-yl)tetrahydro-1H-pyrrolo[3,4-c]pyridine-2,5(3H,4H)-diyl]bis(phenylmethanone)
[rel-(3aR,7aS)-3a-(3-methyl-1,2,4-oxadiazol-5-yl)tetrahydro-1H-pyrrolo[3,4-c]pyridine-2,5(3H,4H)-diyl]bis(phenylmethanone)
Compound characteristics
| Compound ID: | S839-0136 |
| Compound Name: | [rel-(3aR,7aS)-3a-(3-methyl-1,2,4-oxadiazol-5-yl)tetrahydro-1H-pyrrolo[3,4-c]pyridine-2,5(3H,4H)-diyl]bis(phenylmethanone) |
| Molecular Weight: | 416.48 |
| Molecular Formula: | C24 H24 N4 O3 |
| Smiles: | Cc1nc([C@@]23CN(CC[C@H]3CN(C2)C(c2ccccc2)=O)C(c2ccccc2)=O)on1 |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 2.1971 |
| logD: | 2.1971 |
| logSw: | -2.324 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 64.72 |
| InChI Key: | NCRYGUKRTSUVPA-GBXCKJPGSA-N |