Basic information
- Standard SMILES
CCOc1ncnc2c1ncn2C1OC(CO)CC1F- InChIKey
RKFMJBUFPFQUKM-UHFFFAOYSA-N- Molecular formula
- C12H15FN4O3
- Average molar mass
- 282.27 g/mol
- Monoisotopic mass
- 282.11281852
Names & identifiers
- Preferred name
- Dideoxypurineriboside6ethoxy2fluoro
- IUPAC
- [5-(6-ethoxypurin-9-yl)-4-fluorooxolan-2-yl]methanol
Names & synonyms
NSC656311CHEMBL275139DTXSID80874307NSC-656311DIDEOXYPURINERIBOSIDE6ETHOXY2FLUORO9-(2,3-Dideoxy-2-fluoropentofuranosyl)-6-ethoxy-9H-purine
Database identifiers
- PubChem CID
- 375962
- DTXSID
DTXSID80874307- ChEMBL
CHEMBL275139
Properties
Computed structural properties
- XLogP
- 0.8
- Topological polar surface area
- 82.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 4
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 338
Experimental & physicochemical properties
LogP0.8
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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