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Chemical structure of GLP-1R Antagonist 1

GC36148

GLP-1R Antagonist 1

Also known as 7-(4-chlorophenyl)-1,3-dimethyl-5,5-bis(trifluoromethyl)-8H-pyrimido[4,5-d]pyrimidine-2,4-dione

GLP-1R Antagonist 1 (compound 5d) is an orally active, CNS penetrant and non-competitive antagonist of glucagon-like peptide 1 receptor (GLP-1R), with an IC50 of 650 nM

ChemicalCAS488097-06-9MW440.73FormulaC16H11ClF6N4O2
CAS number
488097-06-9
Molecular weight
440.73
Formula
C16H11ClF6N4O2
Solubility
DMSO ： 100 mg/mL (226·90 mM; Need ultrasonic)
InChIKey
MFEIZMHODFOWAT-UHFFFAOYSA-N
Catalogue number
GC36148
Brand
GLPBIO
Computed properties PubChem CID 1941609 · XLogP 2.8 · TPSA 65 Ų · H-bond donors 1
XLogP
2.8
TPSA
65 Ų
H-bond donors
1
H-bond acceptors
9
Rotatable bonds
1
Heavy atoms
29

SMILES CN1C2=C(C(=O)N(C1=O)C)C(N=C(N2)C3=CC=C(C=C3)Cl)(C(F)(F)F)C(F)(F)F

Computed descriptors from PubChem (CID 1941609), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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