2-Fluoro-n,n-dimethyl-9-pentofuranosyl-9h-purin-6-amine
Basic information
- CAS
28360-96-5- Standard SMILES
CN(C)c1nc(F)nc2c1ncn2C1OC(CO)C(O)C1O- InChIKey
OAAKTTXSIFEAQY-UHFFFAOYSA-N- Molecular formula
- C12H16FN5O4
- Average molar mass
- 313.29 g/mol
- Monoisotopic mass
- 313.11863217
Names & identifiers
- Preferred name
- 2-Fluoro-n,n-dimethyl-9-pentofuranosyl-9h-purin-6-amine
- IUPAC
- 2-[6-(dimethylamino)-2-fluoropurin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol
Names & synonyms
28360-96-52-fluoro-n,n-dimethyl-9-pentofuranosyl-9h-purin-6-amineNSC123798DTXSID90298510NSC-123798
Database identifiers
- CAS
28360-96-5- PubChem CID
- 276229
- DTXSID
DTXSID90298510
Properties
Computed structural properties
- XLogP
- 0.2
- Topological polar surface area
- 117 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 9
- Rotatable bonds
- 3
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 406
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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