1,3-Oxathiolane-2-methanol, 5-(6-amino-2-fluoro-9H-purin-9-yl)-, (2S-cis)-
Basic information
- CAS
149819-71-6- Standard SMILES
Nc1nc(F)nc2c1ncn2[C@H]1CS[C@@H](CO)O1- InChIKey
FHYHYXRPVWILHN-UHNVWZDZSA-N- Molecular formula
- C9H10FN5O2S
- Average molar mass
- 271.27 g/mol
- Monoisotopic mass
- 271.05392391
Names & identifiers
- Preferred name
- 1,3-Oxathiolane-2-methanol, 5-(6-amino-2-fluoro-9H-purin-9-yl)-, (2S-cis)-
- IUPAC
- [(2S,5R)-5-(6-amino-2-fluoropurin-9-yl)-1,3-oxathiolan-2-yl]methanol
Names & synonyms
Oxathiolan, 2FA-(-)-beta1,3-Oxathiolane-2-methanol, 5-(6-amino-2-fluoro-9H-purin-9-yl)-, (2S-cis)-149819-71-6(-)-(2S,5R)-2-Fluoro-6-amino-9-(2-(hydroxymethyl)-1,3-oxathiolan-5-yl)purine(-)-(2S,5R)-2-Fluoro-6-amino-9-[2-(hydroxymethyl)-1,3-oxathiolan-5-yl]purineOxathiolan, 2FA-(-).b.CHEMBL89759DTXSID10164405[(2S,5R)-5-(6-amino-2-fluoro-9H-purin-9-yl)-1,3-oxathiolan-2-yl]methanol[(2S,5R)-5-(6-amino-2-fluoro-purin-9-yl)-1,3-oxathiolan-2-yl]methanol
Database identifiers
- CAS
149819-71-6- PubChem CID
- 455182
- DTXSID
DTXSID10164405- ChEMBL
CHEMBL89759- Nikkaji
- J558.751D
Properties
Computed structural properties
- XLogP
- 0.4
- Topological polar surface area
- 124 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 2
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 315
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…