Bosentan 13C6

Product Name Bosentan 13C6
Alternate Names Bosentan Stable Isotopes, Stable Isotopes of Bosentan
CAT No. CS-O-11952
CAS No. 147536-97-8(Unlabeled)
Category Stable Isotopes
Stock IN-Stock
Mol. Wt. 557.57 g/mol
Mol. For. C₂₁[¹³C]₆H₂₉N₅O₆S
Hazardous This is a Hazardous Compound
COA View Sample COA
MSDS View Sample MSDS
Parent API Bosentan
Smileys COC1=C(C=CC=C1)OC(C(N[S](=O)([13C]2=[13CH][13CH]=[13C](C(C)(C)C)[13CH]=[13CH]2)=O)=NC(C3=NC=CC=N3)=N4)=C4OCCO
Canonical Smiles CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)NC2=C(C(=NC(=N2)C3=NC=CC=N3)OCCO)OC4=CC=CC=C4OC
InchIKey GJPICJJJRGTNOD-UHFFFAOYSA-N
Inchl InChI=1S/C27H29N5O6S/c1-27(2,3)18-10-12-19(13-11-18)39(34,35)32-23-22(38-21-9-6-5-8-20(21)36-4)26(37-17-16-33)31-25(30-23)24-28-14-7-15-29-24/h5-15,33H,16-17H2,1-4H3,(H,30,31,32)
IUPAC 4-tert-butyl-N-[6-(2-hydroxyethoxy)-5-(2-methoxyphenoxy)-2-pyrimidin-2-ylpyrimidin-4-yl]benzenesulfonamide
Controlled No
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Bosentan is a medication used to treat pulmonary arterial hypertension (PAH) and is marketed under the brand name Tracleer. Bosentan 13C6 is a stable isotope-labeled form of Bosentan that is used for pharmacokinetic, metabolic, and toxicology studies. Bosentan is classified as an endothelin receptor antagonist, which means that it blocks the action of endothelin, a peptide hormone that causes constriction of blood vessels and increased blood pressure. By blocking the action of endothelin, Bosentan can dilate blood vessels and reduce the workload on the heart, improving symptoms of PAH. Bosentan is absorbed rapidly after oral administration and undergoes extensive metabolism in the liver. Bosentan 13C6 is used in studies to determine the metabolic pathways of Bosentan and its metabolites, as well as to quantify the drug in biological samples. Chemically, Bosentan 13C6 is identical to Bosentan, except that six carbon atoms in the molecule are labeled with the stable isotope carbon-13. This labeling does not change the pharmacological properties of Bosentan, but it allows for more accurate analysis of the drug in biological samples. Overall, Bosentan 13C6 is an important tool for studying the pharmacokinetics and metabolism of Bosentan, which can lead to a better understanding of how the drug works and how it can be used more effectively in the treatment of PAH.

Related Compounds

Hydroxy Bosentan D4 | Bosentan 13C2D4 | Bosentan D4 | Hydroxy Bosentan D6 |

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