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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Energy Chemical
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