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Chemical structure of TAK-020

GC64120

TAK-020

Also known as 3-[1-[(3S)-1-prop-2-enoylpyrrolidin-3-yl]oxyisoquinolin-3-yl]-1,4-dihydro-1,2,4-triazol-5-one

TAK-020 is a covalent Btk inhibitor, which becomes the clinical candidate

ChemicalCAS1627603-21-7MW351.36FormulaC18H17N5O3
CAS number
1627603-21-7
Molecular weight
351.36
Formula
C18H17N5O3
Solubility
DMSO ： 16·67 mg/mL (47·44 mM; ultrasonic and warming and heat to 60°C)
InChIKey
HIMUHMBGRATXMK-LBPRGKRZSA-N
Catalogue number
GC64120
Brand
GLPBIO
Computed properties PubChem CID 136286736 · XLogP 2 · TPSA 95.9 Ų · H-bond donors 2
XLogP
2
TPSA
95.9 Ų
H-bond donors
2
H-bond acceptors
5
Rotatable bonds
4
Heavy atoms
26

SMILES C=CC(=O)N1CC[C@@H](C1)OC2=NC(=CC3=CC=CC=C32)C4=NNC(=O)N4

Computed descriptors from PubChem (CID 136286736), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

Ordering in Israel

Lead time
Ships from the manufacturer to your lab in 8–14 business days; customs and cold chain handled by LABO Scientific.
Pricing
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Documents
Lot certificate of analysis and manufacturer SDS are emailed with your order confirmation.
Who we serve
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