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Chemical structure of BET-IN-1

GC31831

BET-IN-1

Also known as 4-[8-methoxy-1-[(2R)-1-methoxypropan-2-yl]-2-(oxan-4-yl)imidazo[4,5-c]quinolin-7-yl]-3,5-dimethyl-1,2-oxazole

BET-IN-1 is a pan-inhibitor of all eight BET bromodomains, and selectivity over other representative bromodomain-containing proteins

ChemicalCAS1422554-34-4MW450.53FormulaC25H30N4O4
CAS number
1422554-34-4
Molecular weight
450.53
Formula
C25H30N4O4
Solubility
DMSO ： ≥ 32 mg/mL (71·03 mM)
InChIKey
HYPXHDJBILNWLI-CQSZACIVSA-N
Catalogue number
GC31831
Brand
GLPBIO
Computed properties PubChem CID 71258968 · XLogP 3.2 · TPSA 84.4 Ų · H-bond donors 0
XLogP
3.2
TPSA
84.4 Ų
H-bond donors
0
H-bond acceptors
7
Rotatable bonds
6
Heavy atoms
33

SMILES CC1=C(C(=NO1)C)C2=C(C=C3C(=C2)N=CC4=C3N(C(=N4)C5CCOCC5)[C@H](C)COC)OC

Computed descriptors from PubChem (CID 71258968), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

Ordering in Israel

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Pricing
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Documents
Lot certificate of analysis and manufacturer SDS are emailed with your order confirmation.
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