1065472-77-6
1065472-77-6
Chemical Structure
Bosentan-d4
- CAS No.: 1065472-77-6
- Formula:C27H25D4N5O6S
- Molecular Weight:555.64
IUPAC Name: 4-(tert-butyl)-N-(6-(2-hydroxyethoxy-1,1,2,2-d4)-5-(2-methoxyphenoxy)-[2,2'-bipyrimidin]-4-yl)benzenesulfonamide
InChIKey: GJPICJJJRGTNOD-RZOBCMOLSA-N
SMILES: O=S(C1=CC=C(C(C)(C)C)C=C1)(NC2=NC(C3=NC=CC=N3)=NC(OC([2H])([2H])C([2H])([2H])O)=C2OC4=CC=CC=C4OC)=O
Biological Activity: Bosentan-d4 is the deuterium labeled Bosentan. Bosentan is a competitive and dual antagonist of endothelin-1 (ET) for the ETA and ETB receptors with Ki of 4.7 nM and 95 nM in human SMC, respectively.
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Bosentan-d4 | Bosentan-d4 is the deuterium labeled Bosentan. Bosentan is a competitive and dual antagonist of endothelin-1 (ET) for the ETA and ETB receptors with Ki of 4.7 nM and 95 nM in human SMC, respectively. | |||||||||||||||||||||
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Bosentan | 99.94% | Bosentan is a competitive and dual antagonist of endothelin-1 (ET) for the ETA and ETB receptors with Ki of 4.7 nM and 95 nM in human SMC, respectively. | ||||||||||||||||||||
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Structural Analogs
-
Similarity Score 0.99
HY-A0013ARBosentan hydrate (Standard) -
Similarity Score 0.92
HY-121385Hydroxy bosentan -
Similarity Score 0.91
HY-145516Desmethyl Bosentan -
Similarity Score 0.86
HY-78096O-Deshydroxyethyl bosentan -
Similarity Score 0.85
HY-135390Hydroxy desmethyl Bosentan -
Similarity Score 0.83
HY-121385SHydroxy Bosentan-d6 -
Similarity Score 0.79
HY-121385S1Hydroxy Bosentan-d4 -
Similarity Score 0.79
![N-[6-Chloro-5-(2-methoxyphenoxy)[2,2'-bipyrimidin]-4-yl]-4-(1,1-dimethylethyl)-Benzenesulfonamide (Standard) Chemical Structure](//file.medchemexpress.com/product_pic/hy-i0006r.gif)
HY-I0006RN-[6-Chloro-5-(2-methoxyphenoxy)[2,2'-bipyrimidin]-4-yl]-4-(1,1-dimethylethyl)-Benzenesulfonamide (Standard) -
Similarity Score 0.78
HY-157658K-8794 -
Explore the MedChemAI to find more analogs
![N-[6-Chloro-5-(2-methoxyphenoxy)[2,2'-bipyrimidin]-4-yl]-4-(1,1-dimethylethyl)-Benzenesulfonamide (Standard) Chemical Structure](http://file.medchemexpress.com/product_pic/hy-i0006r.gif)
