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Chemical structure of GAT228

GC43739

GAT228

Also known as 3-[(1R)-2-nitro-1-phenylethyl]-2-phenyl-1H-indole

GAT228 is an allosteric agonist of cannabinoid receptor 1 (CB1), the R-(+)-enantiomer of the CB1 positive allosteric modulator (PAM) GAT229, and a component of the racemic mixture GAT211, which acts as both an agonist and PAM

ChemicalCAS1446648-15-2MW342.4FormulaC22H18N2O2
CAS number
1446648-15-2
Molecular weight
342.4
Formula
C22H18N2O2
Solubility
DMSO： 20 mg/ml
InChIKey
OHZDCJJHWPHZJD-LJQANCHMSA-N
Catalogue number
GC43739
Brand
GLPBIO
Computed properties PubChem CID 716594 · XLogP 5.2 · TPSA 61.6 Ų · H-bond donors 1
XLogP
5.2
TPSA
61.6 Ų
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
4
Heavy atoms
26

SMILES C1=CC=C(C=C1)C2=C(C3=CC=CC=C3N2)[C@H](C[N+](=O)[O-])C4=CC=CC=C4

Computed descriptors from PubChem (CID 716594), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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Documents
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