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BMT-145027

CAT: 0013-GTR19178213-01Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19178213-01Size:5 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
BMT-145027 is a selective positive allosteric modulator (PAM) of the mGluR5 receptor, exhibiting an EC50 of 47 nM with no intrinsic agonist activity. This compound is a valuable research tool for investigating mGluR5 function in neurological disorders, facilitating both in vitro binding studies and in vivo behavioral models.
CAS Number
2018282-44-3
Product Name Alternative
Inhibit, Inhibitor, Metabotropic glutamate receptors, mGluR, mGluR5, BMT145027, BMT-145027, BMT 145027
Field of Research
Neuroscience
Purity
99.50% (May vary between batches)
Solubility
DMSO:2 mg/mL (4.56 mM)
Smiles
FC (F) (F) c1cc (ccc1Cl) -c1n[nH]c2nc (-c3ccccc3) c (C#N) c (C3CC3) c12
Molecular Formula
C23H14ClF3N4
Molecular Weight
438.83
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

3-[4-Chloro-3-(trifluoromethyl)phenyl]-4-cyclopropyl-6-phenyl-2H-pyrazolo[3,4-b]pyridine-5-carbonitrile
CAS Number2018282-44-3
PubChem CID129012190
IUPAC Name3-[4-chloro-3-(trifluoromethyl)phenyl]-4-cyclopropyl-6-phenyl-2H-pyrazolo[3,4-b]pyridine-5-carbonitrile
Molecular FormulaC23H14ClF3N4
Molecular Weight438.8
XLogP6.3
Topological Polar Surface Area65.4
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count6
Rotatable Bond Count3
Heavy Atom Count31
Formal Charge0
Complexity699
SMILES
C1CC1C2=C(C(=NC3=NNC(=C23)C4=CC(=C(C=C4)Cl)C(F)(F)F)C5=CC=CC=C5)C#N
InChI
InChI=1S/C23H14ClF3N4/c24-17-9-8-14(10-16(17)23(25,26)27)21-19-18(12-6-7-12)15(11-28)20(29-22(19)31-30-21)13-4-2-1-3-5-13/h1-5,8-10,12H,6-7H2,(H,29,30,31)
InChIKey
UXLUNMKSQUMWLH-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 3-[4-Chloro-3-(trifluoromethyl)phenyl]-4-cyclopropyl-6-phenyl-2H-pyrazolo[3,4-b]pyridine-5-carbonitrile
CAS: 2018282-44-3
CID: 129012190
Formula: C23H14ClF3N4
MW: 438.8
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight438.8
XLogP36.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count6
Rotatable Bond Count3
Exact Mass438.0859086
Monoisotopic Mass438.0859086
Topological Polar Surface Area65.4 Ų
Heavy Atom Count31
Formal Charge0
Complexity699
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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Alternative Products

CatalogName
TFD28244-01BMT-145027
HY-100728RBMT-145027 (Standard)
A12457-50BMT-145027 50mg
A12457-25BMT-145027 25mg
A12457-10BMT-145027 10mg
A12457-2BMT-145027 2mg
A12457-100BMT-145027 100mg
A12457-5BMT-145027 5mg
A12457-1BMT-145027 1mg
A12457-200BMT-145027 200mg

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