Products 1416263-36-9

CAS 1416263-36-9 appears in our catalog under these names: Ezetimibe Impurity 82, Ezetimibe Impurity 75. Offered by: Chemat Brand. Available pack sizes: on request.

Ezetimibe Impurity 82
Chemat Brand
  • size: on request
  • Variants: 1
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Ezetimibe Impurity 75
Chemat Brand
  • size: on request
  • Variants: 1
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Structural formula: {0} (CAS {1})

(3R,6S)-3-[(S)-(4-fluoroanilino)-(4-phenylmethoxyphenyl)methyl]-6-(4-fluorophenyl)oxan-2-one (CAS 1416263-36-9) is a chemical compound with the molecular formula C31H27F2NO3 and a molecular weight of 499.5 g/mol. IUPAC name: (3R,6S)-3-[(S)-(4-fluoroanilino)-(4-phenylmethoxyphenyl)methyl]-6-(4-fluorophenyl)oxan-2-one. InChIKey: ISQMQHNWBSQAAD-DYIKCSJPSA-N.

Identity
Molecular formulaC31H27F2NO3
Molecular weight499.5 g/mol
IUPAC name(3R,6S)-3-[(S)-(4-fluoroanilino)-(4-phenylmethoxyphenyl)methyl]-6-(4-fluorophenyl)oxan-2-one
InChIKeyISQMQHNWBSQAAD-DYIKCSJPSA-N
SMILESC1C[C@H](OC(=O)[C@H]1[C@@H](C2=CC=C(C=C2)OCC3=CC=CC=C3)NC4=CC=C(C=C4)F)C5=CC=C(C=C5)F

Computed by PubChem (NCBI)

Isomers (same molecular formula)
(3S,4S)-1-(4-fluorophenyl)-3-[(3S)-3-(4-fluorophenyl)-3-hydroxypropyl]-4-(4-phenylmethoxyphenyl)azetidin-2-one C31H27F2NO3
(3R,4S)-1-(4-fluorophenyl)-3-[(3R)-3-(4-fluorophenyl)-3-hydroxypropyl]-4-(4-phenylmethoxyphenyl)azetidin-2-one C31H27F2NO3
(3R,4R)-1-(4-fluorophenyl)-3-[(3R)-3-(4-fluorophenyl)-3-hydroxypropyl]-4-(4-phenylmethoxyphenyl)azetidin-2-one C31H27F2NO3
(3R,4S)-1-(4-fluorophenyl)-3-[(3S)-3-(4-fluorophenyl)-3-phenylmethoxypropyl]-4-(4-hydroxyphenyl)azetidin-2-one C31H27F2NO3
(3S,4S)-1-(4-fluorophenyl)-3-[(3R)-3-(4-fluorophenyl)-3-hydroxypropyl]-4-(4-phenylmethoxyphenyl)azetidin-2-one C31H27F2NO3
(3R,4S)-1-(4-fluorophenyl)-3-[(3S)-3-(4-fluorophenyl)-3-hydroxypropyl]-4-(4-phenylmethoxyphenyl)azetidin-2-one C31H27F2NO3