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Chemical structure of Lp-PLA2 -IN-1

GC32224

Lp-PLA2 -IN-1

Also known as 8-[[3,5-difluoro-4-[[6-(trifluoromethyl)-3-pyridinyl]oxy]phenyl]methoxy]-1-methyl-3,4-dihydro-2H-pyrimido[1,2-c]pyrimidin-6-one

Lp-PLA2 -IN-1 is a potent Lipoprotein-associated phospholipase A2 (Lp-PLA2) inhibitor

ChemicalCAS1420367-28-7MW468.38FormulaC21H17F5N4O3
CAS number
1420367-28-7
Molecular weight
468.38
Formula
C21H17F5N4O3
Solubility
Ethanol ： 25 mg/mL (53·38 mM)
InChIKey
QJIGPJZJKXZSNF-UHFFFAOYSA-N
Catalogue number
GC32224
Brand
GLPBIO
Computed properties PubChem CID 71236597 · XLogP 3.4 · TPSA 67.3 Ų · H-bond donors 0
XLogP
3.4
TPSA
67.3 Ų
H-bond donors
0
H-bond acceptors
10
Rotatable bonds
5
Heavy atoms
33

SMILES CN1CCCN2C1=CC(=NC2=O)OCC3=CC(=C(C(=C3)F)OC4=CN=C(C=C4)C(F)(F)F)F

Computed descriptors from PubChem (CID 71236597), 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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