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Chemical structure of Dapagliflozin impurity

GC38174

Dapagliflozin impurity

Also known as (2S,3R,4S,5S,6R)-2-[4-chloro-3-[(4-ethoxyphenyl)methyl]phenyl]-6-(hydroxymethyl)oxane-2,3,4,5-tetrol

Dapagliflozin impurity is an enantiomer of Dapagliflozin which is a sodium-glucose transporter 2 inhibitor

ChemicalCAS960404-86-8MW424.87FormulaC21H25ClO7
CAS number
960404-86-8
Molecular weight
424.87
Formula
C21H25ClO7
Solubility
DMSO : 25 mg/mL (58·84 mM; Need ultrasonic)
InChIKey
KYDGWGYAUCJZDV-ADAARDCZSA-N
Catalogue number
GC38174
Brand
GLPBIO
Computed properties PubChem CID 59648701 · XLogP 1.6 · TPSA 120 Ų · H-bond donors 5
XLogP
1.6
TPSA
120 Ų
H-bond donors
5
H-bond acceptors
7
Rotatable bonds
6
Heavy atoms
29

SMILES CCOC1=CC=C(C=C1)CC2=C(C=CC(=C2)[C@]3([C@@H]([C@H]([C@@H]([C@H](O3)CO)O)O)O)O)Cl

Computed descriptors from PubChem (CID 59648701), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

Ordering in Israel

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