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Chemical structure of N-desmethyl Rosiglitazone

GC41380

N-desmethyl Rosiglitazone

Also known as 5-[[4-[2-(pyridin-2-ylamino)ethoxy]phenyl]methyl]-1,3-thiazolidine-2,4-dione

N-desmethyl Rosiglitazone is a major metabolite of rosiglitazone, a potent and selective PPARγ ligand present in formulations that have been used to treat type 2 diabetes

ChemicalCAS257892-31-2MW343.4FormulaC17H17N3O3S
CAS number
257892-31-2
Molecular weight
343.4
Formula
C17H17N3O3S
Solubility
DMF： 25 mg/ml,DMSO： 34 mg/ml,DMSO：PBS(pH 7·2) (1：3)： 0·5 mg/ml,Ethanol： 1 mg/ml
InChIKey
ZJQTVMXUIGXRMR-UHFFFAOYSA-N
Catalogue number
GC41380
Brand
GLPBIO
Computed properties PubChem CID 12000328 · XLogP 3 · TPSA 106 Ų · H-bond donors 2
XLogP
3
TPSA
106 Ų
H-bond donors
2
H-bond acceptors
6
Rotatable bonds
7
Heavy atoms
24

SMILES C1=CC=NC(=C1)NCCOC2=CC=C(C=C2)CC3C(=O)NC(=O)S3

Computed descriptors from PubChem (CID 12000328), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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