253688-62-9

253688-62-9 structure
253688-62-9 structure
  • Name: Hydroxy Desmethyl Bosentan
  • Chemical Name: N-[6-(2-hydroxyethoxy)-5-(2-hydroxyphenoxy)-2-pyrimidin-2-ylpyrimidin-4-yl]-4-(1-hydroxy-2-methylpropan-2-yl)benzenesulfonamide
  • CAS Number: 253688-62-9
  • Molecular Formula: C26H27N5O7S
  • Molecular Weight: 553.58700
  • Catalog: Research Areas Cardiovascular Disease
  • Create Date: 2016-05-24 03:30:56
  • Modify Date: 2025-08-22 17:12:33
  • Hydroxy desmethyl Bosentan (Ro 64-105) is a Bosentan metabolism produced by the cytochrome P450 enzymes CYP2C9 and CYP3A4 in the liver[1]. 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. Bosentan can be used in treatment of pulmonary arterial hypertension[2].

Name N-[6-(2-hydroxyethoxy)-5-(2-hydroxyphenoxy)-2-pyrimidin-2-ylpyrimidin-4-yl]-4-(1-hydroxy-2-methylpropan-2-yl)benzenesulfonamide
Synonyms Hydroxy Desmethyl Bosentan
Bosentan Impurity 3
Description Hydroxy desmethyl Bosentan (Ro 64-105) is a Bosentan metabolism produced by the cytochrome P450 enzymes CYP2C9 and CYP3A4 in the liver[1]. 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. Bosentan can be used in treatment of pulmonary arterial hypertension[2].
Related Catalog
References

[1]. Lepri S, et al. Metabolism study and biological evaluation of bosentan derivatives. Eur J Med Chem. 2016 Oct 4;121:658-670.

[2]. Dhillon S, et al. Bosentan: a review of its use in the management of mildly symptomatic pulmonary arterial hypertension. Am J Cardiovasc Drugs. 2009;9(5):331-50.

Density 1.426g/cm3
Boiling Point 782ºC at 760 mmHg
Molecular Formula C26H27N5O7S
Molecular Weight 553.58700
Flash Point 426.7ºC
Exact Mass 553.16300
PSA 185.26000
LogP 4.02710
Vapour Pressure 9.41E-26mmHg at 25°C
Index of Refraction 1.643
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