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Chemical structure of Lansoprazole Sulfide D4

GC60975

Lansoprazole Sulfide D4

Also known as 4,5,6,7-tetradeuterio-2-[[3-methyl-4-(2,2,2-trifluoroethoxy)-2-pyridinyl]methylsulfanyl]-1H-benzimidazole

Lansoprazole Sulfide D4 is a deuterium labeled Lansoprazole Sulfide

ChemicalCAS1216682-38-0MW357.39FormulaC16H10D4F3N3OS
CAS number
1216682-38-0
Molecular weight
357.39
Formula
C16H10D4F3N3OS
InChIKey
CCHLMSUZHFPSFC-QFFDRWTDSA-N
Catalogue number
GC60975
Brand
GLPBIO
Computed properties PubChem CID 45039649 · XLogP 4.2 · TPSA 76.1 Ų · H-bond donors 1
XLogP
4.2
TPSA
76.1 Ų
H-bond donors
1
H-bond acceptors
7
Rotatable bonds
5
Heavy atoms
24

SMILES [2H]C1=C(C(=C2C(=C1[2H])NC(=N2)SCC3=NC=CC(=C3C)OCC(F)(F)F)[2H])[2H]

Computed descriptors from PubChem (CID 45039649), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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