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CB1 antagonist 2

CAT: 0013-GTR19175058-03Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19175058-03Size:10 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
AM4113 is a potent and selective cannabinoid CB1 receptor antagonist with an in vivo IC50 of 25.5 nM. This compound is a valuable research tool for investigating the endocannabinoid system in studies of metabolism, obesity, and substance abuse, utilizing both in vitro and in vivo experimental models.
CAS Number
614726-85-1
Product Name Alternative
CannabinoidReceptor, Cannabinoid Receptor, AM 4113, AM-4113, AM4113, CB, CB1, CB1 antagonist 2, CB-1 antagonist 2, Inhibitor, inhibit
Field of Research
Neuroscience; Pharmacology & Drug Discovery, Pharmacology & Drug Discovery
Purity
99.75% (May vary between batches)
Solubility
DMSO:1.9 mg/mL (4.99 mM) ; H2O:< 0.1 mg/mL (insoluble) ;10% DMSO+40% PEG300+5% Tween 80+45% Saline:1 mg/mL (2.63 mM)
Smiles
Cc1c (nn (c1-c1ccc (Cl) cc1) -c1ccc (Cl) cc1Cl) C (N) =O
Molecular Formula
C17H12Cl3N3O
Molecular Weight
380.66
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

5-(4-Chlorophenyl)-1-(2,4-dichlorophenyl)-4-methyl-1H-Pyrazole-3-carboxamide
CAS Number614726-85-1
PubChem CID66844170
IUPAC Name5-(4-chlorophenyl)-1-(2,4-dichlorophenyl)-4-methylpyrazole-3-carboxamide
Molecular FormulaC17H12Cl3N3O
Molecular Weight380.7
XLogP5
Topological Polar Surface Area60.9
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count3
Heavy Atom Count24
Formal Charge0
Complexity458
SMILES
CC1=C(N(N=C1C(=O)N)C2=C(C=C(C=C2)Cl)Cl)C3=CC=C(C=C3)Cl
InChI
InChI=1S/C17H12Cl3N3O/c1-9-15(17(21)24)22-23(14-7-6-12(19)8-13(14)20)16(9)10-2-4-11(18)5-3-10/h2-8H,1H3,(H2,21,24)
InChIKey
BBUKVPCUOHFAQN-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 5-(4-Chlorophenyl)-1-(2,4-dichlorophenyl)-4-methyl-1H-Pyrazole-3-carboxamide
CAS: 614726-85-1
CID: 66844170
Formula: C17H12Cl3N3O
MW: 380.7
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight380.7
XLogP35
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count3
Exact Mass379.004595
Monoisotopic Mass379.004595
Topological Polar Surface Area60.9 Ų
Heavy Atom Count24
Formal Charge0
Complexity458
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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