Basic information
- Standard SMILES
O=c1ccc2nc(NC3=NC[C@@]4(CN5CCC4CC5)O3)sc2[nH]1- InChIKey
VEAWPMXEROMSKF-HNNXBMFYSA-N- Molecular formula
- C15H17N5O2S
- Average molar mass
- 331.4 g/mol
Names & identifiers
- Preferred name
- (R)-2-(4H-1'-azaspiro[oxazole-5,3'-bicyclo[2.2.2]octane]-2-ylamino)thiazolo[5,4-b]pyridin-5(4H)-one
- IUPAC
- 2-[[(3R)-spiro[1-azabicyclo[2.2.2]octane-3,5'-4H-1,3-oxazole]-2'-yl]amino]-4H-[1,3]thiazolo[5,4-b]pyridin-5-one
Names & synonyms
SCHEMBL558957VEAWPMXEROMSKF-HNNXBMFYSA-N(R)-2-(4H-1'-azaspiro[oxazole-5,3'-bicyclo[2.2.2]octane]-2-ylamino)thiazolo[5,4-b]pyridin-5(4H)-one
Database identifiers
- PubChem CID
- 58088071
Properties
Computed structural properties
- XLogP
- 0.8
- Topological polar surface area
- 107 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 2
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 588
Related reactions
2 records
Compound notes
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