Basic information
- Standard SMILES
O=C1O[C@]2(CN3CCC2CC3)CN1c1cc(-c2ccncc2)cs1- InChIKey
IHHPOAGKJCODST-GOSISDBHSA-N- Molecular formula
- C18H19N3O2S
- Average molar mass
- 341.4 g/mol
Names & identifiers
- Preferred name
- (R)-3'-[4-(4-Pyridyl)thiophen-2-yl]spiro[1-azabicyclo[2.2.2]octan-3,5'-oxazolidin]-2'-one
- IUPAC
- (5R)-3-(4-pyridin-4-ylthiophen-2-yl)spiro[1,3-oxazolidine-5,3'-1-azabicyclo[2.2.2]octane]-2-one
Names & synonyms
SCHEMBL4459499IHHPOAGKJCODST-GOSISDBHSA-N(R)-3'-[4-(4-Pyridyl)thiophen-2-yl]spiro[1-azabicyclo[2.2.2]octan-3,5'-oxazolidin]-2'-one
Database identifiers
- PubChem CID
- 11233142
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 73.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 504
Related reactions
1 records
Compound notes
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