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DA-023

CAT: 0013-GTR19235524-03Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19235524-03Size:100 mg
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Description
DA-023 (Compound 4) is a potent and selective positive allosteric modulator (PAM) for the EAAT2 transporter, with an EC50 of 1 nM. This small molecule is a valuable research tool for investigating glutamate clearance in models of neurological disorders, both in cellular assays and animal studies.
CAS Number
2585643-97-4
Field of Research
Metabolism Research
Smiles
C (C=1N (CCC2=CC=CC=C2) N=NN1) (N3CCN (C) CC3) C=4C=CC=NC4
Molecular Formula
C20H25N7
Molecular Weight
363.46
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

1-Methyl-4-[[1-(2-phenylethyl)tetrazol-5-yl]-pyridin-3-ylmethyl]piperazine
CAS Number2585643-97-4
PubChem CID164930554
IUPAC Name1-methyl-4-[[1-(2-phenylethyl)tetrazol-5-yl]-pyridin-3-ylmethyl]piperazine
Molecular FormulaC20H25N7
Molecular Weight363.5
XLogP1.8
Topological Polar Surface Area63
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count6
Rotatable Bond Count6
Heavy Atom Count27
Formal Charge0
Complexity434
SMILES
CN1CCN(CC1)C(C2=CN=CC=C2)C3=NN=NN3CCC4=CC=CC=C4
InChI
InChI=1S/C20H25N7/c1-25-12-14-26(15-13-25)19(18-8-5-10-21-16-18)20-22-23-24-27(20)11-9-17-6-3-2-4-7-17/h2-8,10,16,19H,9,11-15H2,1H3
InChIKey
VGNIHZIDQKBDHQ-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 1-Methyl-4-[[1-(2-phenylethyl)tetrazol-5-yl]-pyridin-3-ylmethyl]piperazine
CAS: 2585643-97-4
CID: 164930554
Formula: C20H25N7
MW: 363.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight363.5
XLogP31.8
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count6
Rotatable Bond Count6
Exact Mass363.21714383
Monoisotopic Mass363.21714383
Topological Polar Surface Area63 Ų
Heavy Atom Count27
Formal Charge0
Complexity434
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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