4'-Thiogemcitabine

4-amino-1-[(2R,4S,5R)-3,3-difluoro-4-hydroxy-5-(hydroxymethyl)thiolan-2-yl]pyrimidin-2-one

Also Known As: 4'-Thiogemcitabine|4 -Thiogemcitabine|2'-Deoxy-2',2'-difluoro-4'-thioCytidine|cytidine, 2'-deoxy-2',2'-difluoro-4'-thio-|2 -Deoxy-2 ,2 -difluoro-4 -O-thiacytidine|4 -O-Thia-2 ,2 -difluoro-2 -deoxycytidine|1-[[3,3-Difluoro-4alpha-hydroxy-5beta-(hydroxymethyl)tetrahydrothiophen]-2beta-yl]cytosine|1-[3,3-Difluoro-4alpha-hydroxy-5beta-(hydroxymethyl)tetrahydrothiophene-2beta-yl]cytosine|1-[3,3-Difluoro-4alpha-hydroxy-5beta-(hydroxymethyl)tetrahydrothiophene-2beta-yl]-4-aminopyrimidine-2(1H)-one|4-amino-1-[(2R,4S,5R)-3,3-difluoro-4-hydroxy-5-(hydroxymethyl)thiolan-2-yl]-1,2-dihydropyrimidin-2-one|4-amino-1-[(2R,4S,5S)-3,3-difluoro-4-hydroxy-5-(hydroxymethyl)thiolan-2-yl]pyrimidin-2-one

Molecular Formula	C9H11F2N3O3S
Molecular Weight	279.04892 g/mol
LogP	-0.572
Topological Polar Surface Area	101.37 Ų
Hydrogen Bond Donors	3
Hydrogen Bond Acceptors	6
Rotatable Bonds	2
Exact Mass	279.04892
Monoisotopic Mass	279.04892
Heavy Atoms	18
Complexity	510.0764

Chemical Identifiers

CAS Number	174833-68-2
SMILES	C1=CN(C(=O)N=C1N)[C@H]2C([C@@H]([C@H](S2)CO)O)(F)F