Stable isotope-labeled compounds are used as environmental pollutant standards for the detection of air, water, soil, sediment and food.
In addition to treating various diseases, isotopes are used for imaging, diagnosis, and newborn screening.
Small molecule compounds labeled with stable isotopes can be used as chemical reference for chemical identification, qualitative, quantitative, detection, etc. Various types of NMR solvents can be used to study the structure, reaction mechanism and reaction kinetics of compounds.
Stable isotope labeling allows researchers to study metabolic pathways in vivo in a safe manner.
General Information |
---|
Catalog: BLP-012553 |
CAS: 1215807-38-7 |
Molecular Formula: C21H19D5N4O2S |
Molecular Weight: 401.54 |
Chemical Structure |
---|
Description | rac Mirabegron-[d5] is the labelled analogue 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 | rac Mirabegron-d5; 2-Amino-N-[4-[2-[[2-hydroxy-2-phenylethyl]amino]ethyl]phenyl]-4-thiazoleacetamide-d5; 2-(2-Aminothiazol-4-yl)-4'-[2-[(2-hydroxy-2-phenylethyl)amino]ethyl]acetic Acid Anilide-d5 |
IUPAC Name | 2-(2-amino-1,3-thiazol-4-yl)-N-[4-[2-[[2-hydroxy-2-(2,3,4,5,6-pentadeuteriophenyl)ethyl]amino]ethyl]phenyl]acetamide |
Related CAS | 223673-61-8 (unlabelled) |
Canonical SMILES | C1=CC=C(C=C1)C(CNCCC2=CC=C(C=C2)NC(=O)CC3=CSC(=N3)N)O |
InChI | InChI=1S/C21H24N4O2S/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)/i1D,2D,3D,4D,5D |
InChI Key | PBAPPPCECJKMCM-RALIUCGRSA-N |
Boiling Point | 690.0±55.0 °C at 760 mmHg |
Melting Point | >152°C (dec.) |
Purity | 95% by HPLC; 98% atom D |
Density | 1.3±0.1 g/cm3 |
Solubility | Soluble in Methanol |
Appearance | Off-white Solid |
Storage | Store at -20°C |
Interested in our Service & Products?
Need detailed information?