Basic information
- CAS
128496-20-8- Standard SMILES
Nc1ccn([C@@H]2O[C@H](CO)[C@@H](F)[C@H]2F)c(=O)n1- InChIKey
FTCVKDVKBLADDH-XVFCMESISA-N- Molecular formula
- C9H11F2N3O3
- Average molar mass
- 247.2 g/mol
- Monoisotopic mass
- 247.07684755
Overview
has antiviral activity against HIV-1; structure given in first source
Names & identifiers
- Preferred name
- 1-(2,3-Dideoxy-2,3-difluoroarabinofuranosyl)cytosine
- IUPAC
- 4-amino-1-[(2R,3S,4R,5R)-3,4-difluoro-5-(hydroxymethyl)oxolan-2-yl]pyrimidin-2-one
Names & synonyms
128496-20-81-Ddfac1-(2,3-Dideoxy-2,3-difluoroarabinofuranosyl)cytosineRefChem:739674-amino-1-[(2R,3S,4R,5R)-3,4-difluoro-5-(hydroxymethyl)oxolan-2-yl]pyrimidin-2-one2',3'-dideoxy-2',3'-difluorocytidine4-Amino-1-(2,3-dideoxy-2,3-difluoro-beta-D-arabinofuranosyl)-2(1H)-pyrimidinone248959-89-91-(2,3-Dideoxy-2,3-difluoro-|A-D-ribofuranosyl)cytosine2(1H)-Pyrimidinone, 4-amino-1-(2,3-dideoxy-2,3-difluoro-beta-D-arabinofuranosyl)-
Database identifiers
- CAS
128496-20-8- PubChem CID
- 72264
- Nikkaji
- J1.514.005D
Properties
Computed structural properties
- XLogP
- -0.6
- Topological polar surface area
- 88.2 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 388
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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