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Chemical structure of Inaxaplin

GC64339

Inaxaplin

Also known as 3-[5,7-difluoro-2-(4-fluorophenyl)-1H-indol-3-yl]-N-[(3S,4R)-4-hydroxy-2-oxopyrrolidin-3-yl]propanamide

Inaxaplin (VX-147) is an apolipoprotein L1 (APOL1) function inhibitor (WO2020131807, compound 2)

ChemicalCAS2446816-88-0MW417.38FormulaC21H18F3N3O3
CAS number
2446816-88-0
Molecular weight
417.38
Formula
C21H18F3N3O3
Solubility
DMSO ： 50 mg/mL (119·79 mM; Need ultrasonic)
InChIKey
CTXLPYZCBOVVQK-UZLBHIALSA-N
Catalogue number
GC64339
Brand
GLPBIO
Computed properties PubChem CID 147289591 · XLogP 2.1 · TPSA 94.2 Ų · H-bond donors 4
XLogP
2.1
TPSA
94.2 Ų
H-bond donors
4
H-bond acceptors
6
Rotatable bonds
5
Heavy atoms
30

SMILES C1[C@H]([C@@H](C(=O)N1)NC(=O)CCC2=C(NC3=C2C=C(C=C3F)F)C4=CC=C(C=C4)F)O

Computed descriptors from PubChem (CID 147289591), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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