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Sulfatroxazole

CAT: 0013-GTR19240956-02Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19240956-02Size:50 mg
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Description
Sulfatroxazole (Isosulfafurazole) is a selective endothelin ETA receptor antagonist with an IC50 of 0.26 μM. This small molecule is a valuable research tool for investigating the role of ET-1 signaling in cardiovascular and renal pathophysiology in both cellular and animal models.
CAS Number
23256-23-7
Field of Research
Pharmacology & Drug Discovery
Smiles
O=S (=O) (NC1=NOC (=C1C) C) C2=CC=C (N) C=C2
Molecular Formula
C11H13N3O3S
Molecular Weight
267.3
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Sulfatroxazole

Sulfatroxazole is a small molecule drug. Sulfatroxazole has a monoisotopic molecular weight of 267.07 Da.

CAS Number23256-23-7
PubChem CID31771
IUPAC Name4-amino-N-(4,5-dimethyl-1,2-oxazol-3-yl)benzenesulfonamide
Molecular FormulaC11H13N3O3S
Molecular Weight267.31
XLogP1.3
Topological Polar Surface Area107
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count6
Rotatable Bond Count3
Heavy Atom Count18
Formal Charge0
Complexity373
SMILES
CC1=C(ON=C1NS(=O)(=O)C2=CC=C(C=C2)N)C
InChI
InChI=1S/C11H13N3O3S/c1-7-8(2)17-13-11(7)14-18(15,16)10-5-3-9(12)4-6-10/h3-6H,12H2,1-2H3,(H,13,14)
InChIKey
DAUFGBIKKGOPJA-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Sulfatroxazole
CAS: 23256-23-7
CID: 31771
Formula: C11H13N3O3S
MW: 267.31
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight267.31
XLogP31.3
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count6
Rotatable Bond Count3
Exact Mass267.06776246
Monoisotopic Mass267.06776246
Topological Polar Surface Area107 Ų
Heavy Atom Count18
Formal Charge0
Complexity373
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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