Products for Research Use Only
RegisterLogin

HPG1860

CAT: 0931-T201349-02Size: 50 mgDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:0931-T201349-02Size:50 mg
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
CAS Number
2226133-29-3
Target
FXR
Related Pathways
Metabolism
Bioactivity
HPG1860, an agonist of the farnesoid X receptor (FXR), induces luminescence in reporter gene assays utilizing HEK293T cells expressing human FXR, with an EC50 value of 18 nM. In vivo studies demonstrate that HPG1860 (administered at 1, 3, or 10 mg/kg daily) reduces serum alanine aminotransferase (ALT) and total cholesterol levels in a mouse model of non-alcoholic steatohepatitis (NASH), which was induced by a high-fat diet and carbon tetrachloride (CCl4) . Additionally, this compound decreases hepatic inflammation, fat levels, and fibrosis.
Smiles
C(C=1C(=NOC1C2CC2)C3=C(Cl)C=CC=C3Cl)N4C[C@@H](C)N(CC4)C5=NC=6C(S5)=CC(C(O)=O)=CC6OC
Molecular Formula
C27H26Cl2N4O4S
Molecular Weight
573.49
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

CID 169422740
CAS Number2226133-29-3
PubChem CID169422740
IUPAC Name2-[(2R)-4-[[5-cyclopropyl-3-(2,6-dichlorophenyl)-1,2-oxazol-4-yl]methyl]-2-methylpiperazin-1-yl]-4-methoxy-1,3-benzothiazole-6-carboxylic acid
Molecular FormulaC27H26Cl2N4O4S
Molecular Weight573.5
XLogP3.7
Topological Polar Surface Area120
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count9
Rotatable Bond Count7
Heavy Atom Count38
Formal Charge0
Complexity848
SMILES
C[C@@H]1CN(CCN1C2=NC3=C(C=C(C=C3S2)C(=O)O)OC)CC4=C(ON=C4C5=C(C=CC=C5Cl)Cl)C6CC6
InChI
InChI=1S/C27H26Cl2N4O4S/c1-14-12-32(8-9-33(14)27-30-24-20(36-2)10-16(26(34)35)11-21(24)38-27)13-17-23(31-37-25(17)15-6-7-15)22-18(28)4-3-5-19(22)29/h3-5,10-11,14-15H,6-9,12-13H2,1-2H3,(H,34,35)/t14-/m1/s1
InChIKey
JPEHHEUXHNQIIX-CQSZACIVSA-N
Chemical Structure
2D Structure
2D structure of CID 169422740
CAS: 2226133-29-3
CID: 169422740
Formula: C27H26Cl2N4O4S
MW: 573.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight573.5
XLogP33.7
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count9
Rotatable Bond Count7
Exact Mass572.1051819
Monoisotopic Mass572.1051819
Topological Polar Surface Area120 Ų
Heavy Atom Count38
Formal Charge0
Complexity848
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Alternative Products

CatalogName
GTR19239541-01HPG1860

Popular Products