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Chemical structure of TAS6417

GC32752

TAS6417

Also known as N-[(8S)-4-amino-6-methyl-5-quinolin-3-yl-8,9-dihydropyrimido[5,4-b]indolizin-8-yl]prop-2-enamide

TAS6417 (CLN-081) is a highly effective, orally active and pan-mutation-selective EGFR tyrosine kinase inhibitor with a unique scaffold fitting into the ATP-binding site of the EGFR hinge region, with IC50 values ranging from 1·1-8·0 nM

ChemicalCAS1661854-97-2MW396.44FormulaC23H20N6O
CAS number
1661854-97-2
Molecular weight
396.44
Formula
C23H20N6O
Solubility
DMSO : ≥ 125 mg/mL (315·31 mM)
InChIKey
MKCYPWYURWOKST-INIZCTEOSA-N
Catalogue number
GC32752
Brand
GLPBIO
Computed properties PubChem CID 117918742 · XLogP 2.3 · TPSA 98.7 Ų · H-bond donors 2
XLogP
2.3
TPSA
98.7 Ų
H-bond donors
2
H-bond acceptors
5
Rotatable bonds
3
Heavy atoms
30

SMILES CC1=C[C@@H](CN2C1=C(C3=C(N=CN=C32)N)C4=CC5=CC=CC=C5N=C4)NC(=O)C=C

Computed descriptors from PubChem (CID 117918742), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

Ordering in Israel

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Documents
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