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Chemical structure of CFT1946

GC73432

CFT1946

Also known as (3R)-3-[6-[2-cyano-3-[[ethyl(methyl)sulfamoyl]amino]-6-fluorophenoxy]-4-oxoquinazolin-3-yl]-8-[2-[1-[3-(2,4-dioxo-1,3-diazinan-1-yl)-5-fluoro-1-methylindazol-6-yl]-4-hydroxypiperidin-4-yl]acetyl]-1-oxa-8-azaspiro[4.5]decane

CFT1946 is an orally active, CRBN-based and mutant-selective bifunctional degradation activating compound (BiDAC™) degrader of BRAFV600E with a DC50 of 14 nM in A375 cells

ChemicalCAS2882165-79-7MW958FormulaC45H49F2N11O9S
CAS number
2882165-79-7
Molecular weight
958
Formula
C45H49F2N11O9S
Solubility
DMSO ： 100 mg/mL (104·38 mM; Need ultrasonic)
InChIKey
OCDRMYDQTIPVOI-HHHXNRCGSA-N
Catalogue number
GC73432
Brand
GLPBIO
Computed properties PubChem CID 166168413 · XLogP 2.7 · TPSA 244 Ų · H-bond donors 3
XLogP
2.7
TPSA
244 Ų
H-bond donors
3
H-bond acceptors
17
Rotatable bonds
11
Heavy atoms
68

SMILES CCN(C)S(=O)(=O)NC1=C(C(=C(C=C1)F)OC2=CC3=C(C=C2)N=CN(C3=O)[C@@H]4CC5(CCN(CC5)C(=O)CC6(CCN(CC6)C7=C(C=C8C(=C7)N(N=C8N9CCC(=O)NC9=O)C)F)O)OC4)C#N

Computed descriptors from PubChem (CID 166168413), 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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