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Chemical structure of Modipafant

GC64494

Modipafant

Also known as ethyl (4R)-4-(2-chlorophenyl)-6-methyl-2-[4-(2-methylimidazo[4,5-c]pyridin-1-yl)phenyl]-5-(pyridin-2-ylcarbamoyl)-1,4-dihydropyridine-3-carboxylate

Modipafant (UK-80067), the (+)-enantiomer of UK-74505, is a potent, orally active, and selective platelet-activating factor (PAF) antagonist

ChemicalCAS122957-06-6MW605.09FormulaC34H29ClN6O3
CAS number
122957-06-6
Molecular weight
605.09
Formula
C34H29ClN6O3
InChIKey
ODRYSCQFUGFOSU-SSEXGKCCSA-N
Catalogue number
GC64494
Brand
GLPBIO
Computed properties PubChem CID 3047770 · XLogP 5.6 · TPSA 111 Ų · H-bond donors 2
XLogP
5.6
TPSA
111 Ų
H-bond donors
2
H-bond acceptors
7
Rotatable bonds
8
Heavy atoms
44

SMILES CCOC(=O)C1=C(NC(=C([C@H]1C2=CC=CC=C2Cl)C(=O)NC3=CC=CC=N3)C)C4=CC=C(C=C4)N5C(=NC6=C5C=CN=C6)C

Computed descriptors from PubChem (CID 3047770), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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