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SR-1001

CAT: 0013-GTR19168590-02Size: 25 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19168590-02Size:25 mg
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Description
SR 1001 is a potent inverse agonist targeting the nuclear receptors RORα and RORγ, with inhibitory constants (Kis) of 172 nM and 111 nM, respectively. It is a valuable chemical probe for studying Th17 cell biology, autoimmune mechanisms, and inflammatory diseases in both cellular and animal models.
CAS Number
1335106-03-0
Product Name Alternative
Inhibitor, inhibit, RAR-related orphan receptor, ROR, RORα, RORγ, SR 1001, SR1001, SR-1001
Field of Research
Cardiovascular Research, Cell Biology, Immunology & Inflammation
Purity
>98%
Bioactivity
RORag agonist
Form
Powder
Solubility
Soluble in DMSO (up to 40 mg/ml) or in Ethanol (up to 40 mg/ml) .
Smiles
CC (=O) Nc1nc (C) c (s1) S (=O) (=O) Nc1ccc (cc1) C (O) (C (F) (F) F) C (F) (F) F
Molecular Formula
C15H13F6N6O4S2
Molecular Weight
477.39
Storage Conditions
-20°C
Notes
For research use only.
Other Product Names
N- (5- (N- (4- (1,1,1,3,3,3-Hexafluoro-2-hydroxypropan-2-yl) phenyl) sulphamoyl) -4-methylthiazol-2-yl) acetamide

Chemical Information

SR1001

SR 1001 is a sulfonamide.

CAS Number1335106-03-0
PubChem CID44241473
IUPAC NameN-[5-[[4-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)phenyl]sulfamoyl]-4-methyl-1,3-thiazol-2-yl]acetamide
Molecular FormulaC15H13F6N3O4S2
Molecular Weight477.4
XLogP2.9
Topological Polar Surface Area145
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count13
Rotatable Bond Count5
Heavy Atom Count30
Formal Charge0
Complexity718
SMILES
CC1=C(SC(=N1)NC(=O)C)S(=O)(=O)NC2=CC=C(C=C2)C(C(F)(F)F)(C(F)(F)F)O
InChI
InChI=1S/C15H13F6N3O4S2/c1-7-11(29-12(22-7)23-8(2)25)30(27,28)24-10-5-3-9(4-6-10)13(26,14(16,17)18)15(19,20)21/h3-6,24,26H,1-2H3,(H,22,23,25)
InChIKey
OZBSSKGBKHOLGA-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of SR1001
CAS: 1335106-03-0
CID: 44241473
Formula: C15H13F6N3O4S2
MW: 477.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight477.4
XLogP32.9
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count13
Rotatable Bond Count5
Exact Mass477.02516722
Monoisotopic Mass477.02516722
Topological Polar Surface Area145 Ų
Heavy Atom Count30
Formal Charge0
Complexity718
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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