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Mirabegron-[d5] Hydrochloride

General Information
Catalog: BLP-004767
Molecular Formula: C21H19D5N4O2S.HCl
Molecular Weight: 438.00
Chemical Structure
Mirabegron-[d5] Hydrochloride
Description Mirabegron-[d5] Hydrochloride is the labelled salt of Mirabegron. Mirabegron is an orally bioavailable agonist of the human beta-3 adrenergic receptor, and it is a drug for the treatment of overactive bladder.
Synonyms Mirabegron-D5 Hydrochloride
IUPAC Name 2-(2-amino-1,3-thiazol-4-yl)-N-[4-[2-[[(2R)-2-hydroxy-2-(2,3,4,5,6-pentadeuteriophenyl)ethyl]amino]ethyl]phenyl]acetamide;hydrochloride
Related CAS 1258889-45-0 (free base)
Canonical SMILES C1=CC=C(C=C1)C(CNCCC2=CC=C(C=C2)NC(=O)CC3=CSC(=N3)N)O.Cl
InChI InChI=1S/C21H24N4O2S.ClH/c22-21-25-18(14-28-21)12-20(27)24-17-8-6-15(7-9-17)10-11-23-13-19(26)16-4-2-1-3-5-16;/h1-9,14,19,23,26H,10-13H2,(H2,22,25)(H,24,27);1H/t19-;/m0./s1/i1D,2D,3D,4D,5D;
InChI Key ZGJGVOWYPHPPFA-NQVFCEIPSA-N
Purity ≥90%
Solubility Soluble in DMSO
Appearance Pale Yellow Solid
Storage Store at -20°C

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