| Identification | Back Directory |  [Name]
  (1S,2S,3R,5S)-3-(5-Amino-6-chloro-2-(propylthio)pyrimidin-4-ylamino)-5-(2-hydroxyethoxy)cyclopentane-1,2-diol |  [CAS]
  1402150-32-6 |  [Synonyms]
  (1S,2S,3R,5S)-3-(5-Amino-6-chloro-2-(propylthio)pyrimidin-4-ylamino)-5-(2-hydroxyethoxy)cyclopentane-1,2-diol Ticagrelor Acetonide/(1S,2S,3S,5R)-3-(2-Hydroxyethoxy)-5-[[5-amino-6-chloro-2-(propylthio)pyrimidin-4-yl]amino]cyclopentane-1,2-diol Ticagrelor impurity 1/Ticagrelor Acetonide/(1S,2S,3S,5R)-3-(2-Hydroxyethoxy)-5-[[5-amino-6-chloro-2-(propylthio)pyrimidin-4-yl]amino]cyclopentane-1,2-diol |  [Molecular Formula]
  C14H23ClN4O4S |  [MDL Number]
  MFCD28387008 |  [MOL File]
  1402150-32-6.mol |  [Molecular Weight]
  378.87 |  
 | Chemical Properties | Back Directory |  [Boiling point ]
  615.2±55.0 °C(Predicted) |  [density ]
  1.47±0.1 g/cm3(Predicted) |  [pka]
  13.66±0.70(Predicted) |  [InChI]
  InChI=1S/C14H23ClN4O4S/c1-2-5-24-14-18-12(15)9(16)13(19-14)17-7-6-8(23-4-3-20)11(22)10(7)21/h7-8,10-11,20-22H,2-6,16H2,1H3,(H,17,18,19)/t7-,8+,10+,11-/m1/s1 |  [InChIKey]
  FWGBZSJJCDADJP-YKDSUIRESA-N |  [SMILES]
  [C@@H]1(O)[C@@H](OCCO)C[C@@H](NC2C(N)=C(Cl)N=C(SCCC)N=2)[C@@H]1O |  
 | Hazard Information | Back Directory |  [Uses]
  (1S,2S,3R,5S)-3-(5-amino-6-chloro-2-(propylthio)pyrimidin-4-ylamino)-5-(2-hydroxyethoxy)cyclopentane-1,2-diol is an impurity of Ticagrelor (T437700) which is an anticoagulant used in the treatment of acute coronary syndromes. |  
  
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