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Chemical structure of Canagliflozin

GC13771

Canagliflozin

Also known as (2S,3R,4R,5S,6R)-2-[3-[[5-(4-fluorophenyl)thiophen-2-yl]methyl]-4-methylphenyl]-6-(hydroxymethyl)oxane-3,4,5-triol

Canagliflozin is a sodium glucose co-transporter (SGLT) 2 inhibitor in clinical development for the treatment of type 2 diabetes mellitus

ChemicalCAS842133-18-0MW444.52FormulaC24H25FO5S
CAS number
842133-18-0
Molecular weight
444.52
Formula
C24H25FO5S
Solubility
≥ 22·25mg/mL in DMSO
InChIKey
XTNGUQKDFGDXSJ-ZXGKGEBGSA-N
Catalogue number
GC13771
Brand
GLPBIO
Computed properties PubChem CID 24812758 · XLogP 3.2 · TPSA 118 Ų · H-bond donors 4
XLogP
3.2
TPSA
118 Ų
H-bond donors
4
H-bond acceptors
7
Rotatable bonds
5
Heavy atoms
31

SMILES CC1=C(C=C(C=C1)[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CO)O)O)O)CC3=CC=C(S3)C4=CC=C(C=C4)F

Computed descriptors from PubChem (CID 24812758), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

Ordering in Israel

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