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Chemical structure of K-8012

GC75006

K-8012

Also known as 5-[2-[(3Z)-6-fluoro-2-methyl-3-[(4-propan-2-ylphenyl)methylidene]inden-1-yl]ethyl]-2H-tetrazole

K-8012, a sulindac analog, is a potent antagonist of RXRa

ChemicalCAS1346513-17-4MW374.45FormulaC23H23FN4
CAS number
1346513-17-4
Molecular weight
374.45
Formula
C23H23FN4
InChIKey
XBRDZHUUARVXDN-MTJSOVHGSA-N
Catalogue number
GC75006
Brand
GLPBIO
Computed properties PubChem CID 54589362 · XLogP 4.8 · TPSA 54.5 Ų · H-bond donors 1
XLogP
4.8
TPSA
54.5 Ų
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
5
Heavy atoms
28

SMILES CC\1=C(C2=C(/C1=C\C3=CC=C(C=C3)C(C)C)C=CC(=C2)F)CCC4=NNN=N4

Computed descriptors from PubChem (CID 54589362), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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