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IBC 293

CAT: 0931-T19700-05Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0931-T19700-05Size:100 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
306935-41-1
Target
GPCR
Related Pathways
GPCR/G Protein, Endocrinology/Hormones
Purity
0.9974
Bioactivity
IBC 293 is selective for GPR109B over niacin receptor GPR109A. IBC 293 is a highly selective agonist for GPR109B, a human orphan G-protein-coupled receptor expressed in adipocytes.
Smiles
CC(C)N1N=NC2=CC(=CC=C12)C(O)=O
Molecular Formula
C10H11N3O2
Molecular Weight
205.21
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Ibc 293

1-propan-2-yl-5-benzotriazolecarboxylic acid is a member of benzotriazoles.

CAS Number306935-41-1
PubChem CID2736690
IUPAC Name1-propan-2-ylbenzotriazole-5-carboxylic acid
Molecular FormulaC10H11N3O2
Molecular Weight205.21
XLogP1.5
Topological Polar Surface Area68
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count2
Heavy Atom Count15
Formal Charge0
Complexity257
SMILES
CC(C)N1C2=C(C=C(C=C2)C(=O)O)N=N1
InChI
InChI=1S/C10H11N3O2/c1-6(2)13-9-4-3-7(10(14)15)5-8(9)11-12-13/h3-6H,1-2H3,(H,14,15)
InChIKey
RUTVRAJKELSHCC-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Ibc 293
CAS: 306935-41-1
CID: 2736690
Formula: C10H11N3O2
MW: 205.21
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight205.21
XLogP31.5
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count2
Exact Mass205.085126602
Monoisotopic Mass205.085126602
Topological Polar Surface Area68 Ų
Heavy Atom Count15
Formal Charge0
Complexity257
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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