Basic information
- Standard SMILES
OCC1OC(n2cnc3c(NC4CC4)ncnc32)C(F)C1O- InChIKey
CNJKNVBDLYNJIR-UHFFFAOYSA-N- Molecular formula
- C13H16FN5O3
- Average molar mass
- 309.3 g/mol
Names & identifiers
- Preferred name
- 5-[6-(Cyclopropylamino)purin-9-yl]-4-fluoro-2-(hydroxymethyl)oxolan-3-ol
- IUPAC
- 5-[6-(cyclopropylamino)purin-9-yl]-4-fluoro-2-(hydroxymethyl)oxolan-3-ol
Database identifiers
- PubChem CID
- 19934356
Properties
Computed structural properties
- XLogP
- 1.2
- Topological polar surface area
- 105 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 4
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 415
Related reactions
1 records
Compound notes
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