Cytidine, 2',3'-didehydro-2',3'-dideoxy-3'-fluoro-
Basic information
- CAS
125362-05-2- Standard SMILES
Nc1ccn([C@H]2C=C(F)[C@@H](CO)O2)c(=O)n1- InChIKey
MEVXHGRLPDLNHY-HTRCEHHLSA-N- Molecular formula
- C9H10FN3O3
- Average molar mass
- 227.19 g/mol
- Monoisotopic mass
- 227.07061935
Names & identifiers
- Preferred name
- Cytidine, 2',3'-didehydro-2',3'-dideoxy-3'-fluoro-
- IUPAC
- 4-amino-1-[(2R,5R)-4-fluoro-5-(hydroxymethyl)-2,5-dihydrofuran-2-yl]pyrimidin-2-one
Names & synonyms
125362-05-23'-Fluoro-2',3'-dideoxydidehydrocytidine3'-F-D4CCytidine, 2',3'-didehydro-2',3'-dideoxy-3'-fluoro-4-amino-1-[(2R,5R)-4-fluoro-5-(hydroxymethyl)-2,5-dihydrofuran-2-yl]pyrimidin-2-oneCHEMBL2112549SCHEMBL30976636DTXSID301547422',3'-Didehydro-2',3'-dideoxy-3'-fluoroCytidine.beta.-D-Cytidine, 2',3'-didehydro-2',3'-dideoxy-3'-fluoro-4-Amino-1-[(2R,5R)-4-fluoro-5-(hydroxymethyl)-2,5-dihydrofuran-2-yl]pyrimidin-2(1H)-one
Database identifiers
- CAS
125362-05-2- PubChem CID
- 451615
- DTXSID
DTXSID30154742- ChEMBL
CHEMBL2112549
Properties
Computed structural properties
- XLogP
- -1.8
- Topological polar surface area
- 88.2 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 405
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