Cas no 157212-55-0 (Bosentan (hydrate))

Bosentan (hydrate) structure
Bosentan (hydrate) structure
Product Name:Bosentan (hydrate)
CAS No:157212-55-0
MF:C27H31N5O7S
MW:569.629345178604
MDL:MFCD09751188
CID:65463
PubChem ID:354334055
Update Time:2025-09-18

Bosentan (hydrate) Chemical and Physical Properties

Names and Identifiers

    • 4-(tert-Butyl)-N-(6-(2-hydroxyethoxy)-5-(2-methoxyphenoxy)-[2,2'-bipyrimidin]-4-yl)benzenesulfonamide hydrate
    • Bosentan Monohydrate
    • Benzenesulfonamide
    • Bosentan Hydrate
    • Bosentan Hydrate See B675900
    • Bosetan
    • 4-tert-butyl-N-[6-(2-hydroxyethoxy)-5-(2-methoxyphenoxy)-2-pyrimidin-2-ylpyrimidin-4-yl]benzenesulfonamide,hydrate
    • 4-tert-Butyl-N-[6-(2-hydroxyethoxy)- 5-(2-methoxyphenoxy)-2-(pyrimidin-2-yl)pyrimidin-4-yl]benzenesulfonamide
    • 4-(1,1-Dimethylethyl)-N-[6-(2-hydroxyethoxy)-5-(2-methoxyphenoxy)[2,2′-bipyrimidin]-4-yl]benzenesulfonamide monohydrate
    • 4-Tert-butyl-N- [6-(2-hydroxyethoxy)-5-(2-methoxy-phenoxy)-[2,2′]-bipyrimidin-4-yl]-benzenesulfonamide monohydrate
    • Ro-47-0203
    • 4-(tert-Butyl)-N-[6-(2-hydroxyethoxy)-5-(2-methoxyphenoxy)[2,2'-bipyrimidin]-4-yl]benzenesulfonamide Monohydrate
    • 4-tert-Butyl-N-[6-(2-hydroxyethoxy)-5-(2-methoxyphenoxy)-2-(pyrimidin-2-yl)pyrimidin-4-yl]benzenesulfonamide Monohydrate
    • Bosentan bosentan hydrate
    • Bosentan (200 mg)
    • 4-(tert-Butyl)-N-(6-(2-hydroxyethoxy)-5-(2-methoxyphenoxy)-[2,2'-bipyrimidin]-4-yl)benzenesulfona
    • 4-tert-butyl-N-[6-(2-hydroxyethoxy)-5-(2-Methoxyphenoxy)-2-(pyriMidin-2-yl)pyriMidin-4-yl]benzene-1-sulfonaMide
    • 4-(1,1-dimethylethyl)-n-(6-(2-hydroxyethoxy)-5-(2-methoxyphenoxy)(2,2'-bipyrimidin)-4-yl)benzenesulfonamide monohydrate
    • Benzenesulfonamide, 4-(1,1-dimethylethyl)-N-[6-(2-hydroxyethoxy)-5-(2-methoxyphenoxy)[2,2'-bipyrimidin]-4-yl]-, hydrate (1:1)
    • Bosentan (hydrate)
    • 4-(tert-Butyl)-N-(6-(2-hydroxyethoxy)-5-(2-methoxyphenoxy)-[2,2'-bipyrimidin]-4-yl)benzenesulfonamid
    • 4-tert-butyl-N-(6-(2-hydroxyethoxy)-5-(2-methoxyphenoxy)-2,2'-bipyrimidin-4-yl)benzenesulfonamide hydrate
    • Q326023R30
    • C27H31N5O7S
    • 4-tert-butyl-N-[6-(2-hydroxyethoxy)-5-(2-methoxyphenoxy)-2-pyrimid
    • 4-tert-butyl-N-[6-(2-hydroxyethoxy)-5-(2-methoxyphenoxy)- 2-(pyrimidin-2-yl)pyrimidin-4-yl]benzene-1-sulfonamide monohydrate
    • Bosentan [USAN]
    • BOSENTAN HYDRATE [JAN]
    • UNII-Q326023R30
    • Bosentan (USAN)
    • DTXSID80873178
    • SXTRWVVIEPWAKM-UHFFFAOYSA-N
    • CS-1265
    • BOSENTAN MONOHYDRATE [EMA EPAR]
    • Ro 47-0203/029
    • Bosentan hydrate (JAN)
    • 4-tert-butyl-N-[6-(2-hydroxyethoxy)-5-(2-methoxyphenoxy)-2-pyrimidin-2-yl-pyrimidin-4-yl]benzenesulfonamide hydrate
    • BOSENTAN MONOHYDRATE [MI]
    • 4-tert-butyl-N-[6-(2-hydroxyethoxy)-5-(2-methoxyphenoxy)-2-pyrimidin-2-ylpyrimidin-4-yl]benzenesulfonamide;hydrate
    • J-513868
    • 4-tert-butyl-N-[6-(2-hydroxyethoxy)-5-(2-methoxyphenoxy)-2-(pyrimidin-2-yl)pyrimidin-4-yl]benzene-1-sulfonamide hydrate
    • Benzenesulfonamide, 4-(1,1-dimethylethyl)-N-(6-(2-hydroxyethoxy)-5-(2-methoxyphenoxy)(2,2'-bipyrimidin)-4-yl)-, monohydrate
    • HMS3651P16
    • BOSENTAN MONOHYDRATE [WHO-DD]
    • 4-(tert-Butyl)-N-(6-(2-hydroxyethoxy)-5-(2-methoxyphenoxy)-[2,2`-bipyrimidin]-4-yl)benzenesulfonamide hydrate
    • MLS004774049
    • BOSENTAN [ORANGE BOOK]
    • BCP07069
    • KS-1231
    • AKOS015897290
    • SB17357
    • SCHEMBL617167
    • 4-tert-butyl-N-[6-(2-hydroxyethoxy)-5-(2-methoxyphenoxy)-2,2'-bipyrimidin-4-yl]benzenesulfonamide hydrate
    • AMY20448
    • Bosentan hydrate, >=98% (HPLC)
    • AC-4265
    • HY-A0013A
    • Benzenesulfonamide, 4-(1,1-dimethylethyl)-N-[6-(2-hydroxyethoxy)-5-(2-methoxyphenoxy)[2,2'-bipyrimidin]-4-yl]-, hydrate (1:1); Benzenesulfonamide, 4-(1,1-dimethylethyl)-N-[6-(2-hydroxyethoxy)-5-(2-methoxyphenoxy)[2,2'-bipyrimidin]-4-yl]-, monohydrate (9CI); Bosentan hydrate; Bosentan monohydrate
    • Bosentan [USAN:INN:BAN]
    • CCG-270091
    • SMR003500718
    • FT-0657493
    • 157212-55-0
    • BENZENESULFONAMIDE, 4-(1,1-DIMETHYLETHYL)-N-(6-(2-HYDROXYETHOXY)-5-(2-METHOXYPHENOXY)(2,2'BIPYRIMIDIN)-4-YL)-, MONOHYDRATE
    • CS-M0881
    • Q27114267
    • CHEBI:31300
    • Ro-470203029
    • p-tert-Butyl-N-(6-(2-hydroxyethoxy)-5-(o-methoxyphenoxy)-2-(2-pyrimidinyl)-4-pyrimidinyl)benzenesulfonamide monohydrate
    • Tracleer (TN)
    • s3051
    • Ro-47-0203-029
    • BOSENTAN [USP-RS]
    • MFCD09751188
    • BOSENTAN [VANDF]
    • D01227
    • Tracleer, Bosentan monohydrate
    • Ro-47-0203/029
    • SW199648-2
    • DA-51349
    • DB-229208
    • 4-Tert-butyl-N-(6-(2-hydroxyethoxy)-5-(2-methoxyphenoxy)-2,2-bipyrimidin-4-yl)benzenesulfonamide hydrate
    • MDL： MFCD09751188
    • Inchi： 1S/C27H29N5O6S.H2O/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);1H2
    • InChI Key： SXTRWVVIEPWAKM-UHFFFAOYSA-N
    • SMILES： S(C1C=CC(=CC=1)C(C)(C)C)(NC1C(=C(N=C(C2N=CC=CN=2)N=1)OCCO)OC1C=CC=CC=1OC)(=O)=O.O

Computed Properties

  • Exact Mass: 569.19400
  • Monoisotopic Mass: 569.19441952g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 3
  • Hydrogen Bond Acceptor Count: 12
  • Heavy Atom Count: 40
  • Rotatable Bond Count: 11
  • Complexity: 839
  • Covalently-Bonded Unit Count: 2
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Topological Polar Surface Area: 155

Experimental Properties

  • Color/Form: No data available
  • Melting Point: 111-113°C
  • Boiling Point: 742.3°C at 760 mmHg
  • Flash Point: No data available
  • Solubility: 生物體外In Vitro:DMSO溶解度≥ 250 mg/mL(438.88 mM)Ethanol : 118 mg/mL(207.15 mM;Need ultrasonic and warming)H2O< 0.1 mg/mL(insoluble)*"≥" means soluble可溶, but saturation unknown溶解度未知.
  • PSA: 163.26000
  • LogP: 5.29340
  • Merck: 1353
  • Vapor Pressure: No data available

Bosentan (hydrate) Security Information

Bosentan (hydrate) Pricemore >>

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Bosentan (hydrate) Suppliers

Amadis Chemical Company Limited
Gold Member
Audited Supplier Audited Supplier
(CAS:157212-55-0)Bosentan (hydrate)
Order Number:A809824
Stock Status:in Stock
Quantity:5g
Purity:99%
Pricing Information Last Updated:Friday, 30 August 2024 04:51
Price ($):176.0
Tiancheng Chemical (Jiangsu) Co., Ltd
Gold Member
Audited Supplier Audited Supplier
(CAS:157212-55-0)波生坦(水合物)
Order Number:LE2470824;LE812
Stock Status:in Stock
Quantity:25KG,200KG,1000KG
Purity:99%
Pricing Information Last Updated:Friday, 20 June 2025 12:39
Price ($):discuss personally

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Recommended suppliers
Amadis Chemical Company Limited
(CAS:157212-55-0)Bosentan (hydrate)
A809824
Purity:99%
Quantity:5g
Price ($):176.0
Email
Tiancheng Chemical (Jiangsu) Co., Ltd
(CAS:157212-55-0)波生坦(水合物)
LE2470824;LE812
Purity:99%/99%
Quantity:25KG,200KG,1000KG/25KG,200KG,1000KG
Price ($):Inquiry/Inquiry
Email