Products 2096989-56-7

CAS 2096989-56-7 appears in our catalog under these names: Ticagrelor Related Compound 16, (1S,2R)-Ticagrelor, >95% (HPLC), (1S,2S,3R,5S)-3-(7-(((1S,2R)-2-(3,4-Difluorophenyl)cyclopropyl)amino)-5-(propylthio)-3H-(1,2,3)triazolo(4,5-d)pyrimidin-3-yl)-5-(2-h ydroxyethoxy)cyclopentane-1,2-diol, Ticagrelor impurity 16, 99.51%. Offered by: Chemat Brand, TRC, Biosynth, MedChemExpress. Available pack sizes: on request, 2,5mg, 25mg, 2mg, 5mg, 10mg, 5 mg, 1 mg.

Ticagrelor Related Compound 16
Chemat Brand
  • size: on request
  • Variants: 1
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(1S,2R)-Ticagrelor, >95% (HPLC)
TRC
  • size: 2,5mg, 25mg
  • Variants: 2
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(1S,2S,3R,5S)-3-(7-(((1S,2R)-2-(3,4-Difluorophenyl)cyclopropyl)amino)-5-(propylthio)-3H-(1,2,3)triazolo(4,5-d)pyrimidin-3-yl)-5-(2-h ydroxyethoxy)cyclopentane-1,2-diol
Biosynth
  • size: 2mg, 5mg, 10mg, 25mg
  • Variants: 4
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Ticagrelor impurity 16, 99.51%
MedChemExpress
  • size: 5 mg, 1 mg, 10 mg
  • Variants: 3
from 2135.50
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Structural formula: {0} (CAS {1})

(1S,2S,3R,5S)-3-[7-[[(1S,2R)-2-(3,4-difluorophenyl)cyclopropyl]amino]-5-propylsulfanyltriazolo[4,5-d]pyrimidin-3-yl]-5-(2-hydroxyethoxy)cyclopentane-1,2-diol (CAS 2096989-56-7) is a chemical compound with the molecular formula C23H28F2N6O4S and a molecular weight of 522.6 g/mol. IUPAC name: (1S,2S,3R,5S)-3-[7-[[(1S,2R)-2-(3,4-difluorophenyl)cyclopropyl]amino]-5-propylsulfanyltriazolo[4,5-d]pyrimidin-3-yl]-5-(2-hydroxyethoxy)cyclopentane-1,2-diol. InChIKey: OEKWJQXRCDYSHL-KCODXIBCSA-N.

Identity
Molecular formulaC23H28F2N6O4S
Molecular weight522.6 g/mol
IUPAC name(1S,2S,3R,5S)-3-[7-[[(1S,2R)-2-(3,4-difluorophenyl)cyclopropyl]amino]-5-propylsulfanyltriazolo[4,5-d]pyrimidin-3-yl]-5-(2-hydroxyethoxy)cyclopentane-1,2-diol
InChIKeyOEKWJQXRCDYSHL-KCODXIBCSA-N
SMILESCCCSC1=NC(=C2C(=N1)N(N=N2)[C@@H]3C[C@@H]([C@H]([C@H]3O)O)OCCO)N[C@H]4C[C@@H]4C5=CC(=C(C=C5)F)F

Computed by PubChem (NCBI)

Synonyms: Ticagrelor Impurity, Ticagrelor Impurity C (Ticagrelor Isomer 3), starbld0009799, orb3181245
Related forms of this compound
(1S,2S,3R,5S)-3-[7-[[(1R,2S)-2-(3,4-difluorophenyl)cyclopropyl]amino]-5-propylsulfanyltriazolo[4,5-d]pyrimidin-3-yl]-5-(2-hydroxyethoxy)cyclopentane-1,2-diol C23H28F2N6O4S
(1R,2R,3S,5R)-3-[7-[[(1S,2R)-2-(3,4-difluorophenyl)cyclopropyl]amino]-5-propylsulfanyltriazolo[4,5-d]pyrimidin-3-yl]-5-(2-hydroxyethoxy)cyclopentane-1,2-diol C23H28F2N6O4S
(1S,2S,3R,5S)-3-[7-[[(1R,2R)-2-(3,4-difluorophenyl)cyclopropyl]amino]-5-propylsulfanyltriazolo[4,5-d]pyrimidin-3-yl]-5-(2-hydroxyethoxy)cyclopentane-1,2-diol C23H28F2N6O4S
(1R,2R,3S,5R)-3-[7-[[(1R,2S)-2-(3,4-difluorophenyl)cyclopropyl]amino]-5-propylsulfanyltriazolo[4,5-d]pyrimidin-3-yl]-5-(2-hydroxyethoxy)cyclopentane-1,2-diol C23H28F2N6O4S
(1S,2S,3R,5S)-3-[7-[[(1S,2S)-2-(3,4-difluorophenyl)cyclopropyl]amino]-5-propylsulfanyltriazolo[4,5-d]pyrimidin-3-yl]-5-(2-hydroxyethoxy)cyclopentane-1,2-diol C23H28F2N6O4S
(1S,2S,3R,5S)-3-[7-[[(1R,2S)-2-(3,4-difluorophenyl)cyclopropyl]amino]-5-(1,1,2,2,3,3,3-heptadeuteriopropylsulfanyl)triazolo[4,5-d]pyrimidin-3-yl]-5-(2-hydroxyethoxy)cyclopentane-1,2-diol C23H28F2N6O4S
Isomers (same molecular formula)
(1S,2S,3R,5S)-3-[[3-[(1R,2S)-2-(3,4-difluorophenyl)cyclopropyl]-5-propylsulfanyltriazolo[4,5-d]pyrimidin-7-yl]amino]-5-(2-hydroxyethoxy)cyclopentane-1,2-diol C23H28F2N6O4S
(1S,2S,3R,5S)-3-[7-[[(1R,2S)-2-(2,3-difluorophenyl)cyclopropyl]amino]-5-propylsulfanyltriazolo[4,5-d]pyrimidin-3-yl]-5-(2-hydroxyethoxy)cyclopentane-1,2-diol C23H28F2N6O4S