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Chemical structure of Avatrombopag maleate

GC75182

Avatrombopag maleate

Also known as (Z)-but-2-enedioic acid;1-[3-chloro-5-[[4-(4-chlorothiophen-2-yl)-5-(4-cyclohexylpiperazin-1-yl)-1,3-thiazol-2-yl]carbamoyl]-2-pyridinyl]piperidine-4-carboxylic acid

Avatrombopag maleate (AKR-501) is an orally active, nonpeptide thrombopoietin (TPO) receptor agonist (EC50=3·3 nM)

ChemicalCAS677007-74-8MW765.73FormulaC33H38Cl2N6O7S2
CAS number
677007-74-8
Molecular weight
765.73
Formula
C33H38Cl2N6O7S2
Solubility
DMSO： 175 mg/mL (228·54 mM; Need ultrasonic)
InChIKey
MISPBGHDNZYFNM-BTJKTKAUSA-N
Catalogue number
GC75182
Brand
GLPBIO
Computed properties PubChem CID 9918581 · TPSA 233 Ų · H-bond donors 4 · H-bond acceptors 14
TPSA
233 Ų
H-bond donors
4
H-bond acceptors
14
Rotatable bonds
9
Heavy atoms
50

SMILES C1CCC(CC1)N2CCN(CC2)C3=C(N=C(S3)NC(=O)C4=CC(=C(N=C4)N5CCC(CC5)C(=O)O)Cl)C6=CC(=CS6)Cl.C(=C\C(=O)O)\C(=O)O

Computed descriptors from PubChem (CID 9918581), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

Ordering in Israel

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