Basic information
- Standard SMILES
Cc1nc2ccccc2n1C1C[C@H]2CC[C@@H](C1)N2CCC1(c2ccccc2)CCN(C(=O)c2ccco2)CC1- InChIKey
RYAQYKXNVFXVOM-FITHBNAOSA-N- Molecular formula
- C33H38N4O2
- Average molar mass
- 522.7 g/mol
Names & identifiers
- Preferred name
- 1-((1R,5S)-8-{2-[1-(2-furoyl)-4-phenylpiperidin-4-yl]ethyl}-8-azabicyclo[3.2.1]oct-3-yl)-2-methyl-1H-benzimidazole
- IUPAC
- furan-2-yl-[4-[2-[(1R,5S)-3-(2-methylbenzimidazol-1-yl)-8-azabicyclo[3.2.1]octan-8-yl]ethyl]-4-phenylpiperidin-1-yl]methanone
Names & synonyms
SCHEMBL3526955SCHEMBL13543125RYAQYKXNVFXVOM-FITHBNAOSA-N1-((1R,5S)-8-{2-[1-(2-furoyl)-4-phenylpiperidin-4-yl]ethyl}-8-azabicyclo[3.2.1]oct-3-yl)-2-methyl-1H-benzimidazole
Database identifiers
- PubChem CID
- 58728063
Properties
Computed structural properties
- XLogP
- 6.1
- Topological polar surface area
- 54.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 39
- Formal charge
- 0
- Complexity
- 839
Related reactions
1 records
Compound notes
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