ChemicalBook--->CAS DataBase List--->1402150-32-6

1402150-32-6

1402150-32-6 Structure

1402150-32-6 Structure
IdentificationBack 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 PropertiesBack 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 InformationBack 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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