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Chemical structure of Y06036

GC33285

Y06036

Also known as 5-bromo-2-methoxy-N-(6-methoxy-3-methyl-1,2-benzoxazol-5-yl)benzenesulfonamide

Y06036 is a potent and selective BET inhibitor, which binds to the BRD4(1) bromodomain with Kd value of 82 nM· Antitumor activity

ChemicalCAS1832671-96-1MW427.27FormulaC16H15BrN2O5S
CAS number
1832671-96-1
Molecular weight
427.27
Formula
C16H15BrN2O5S
Solubility
DMSO : 130 mg/mL (304·26 mM)
InChIKey
KVGNGFGTOSOVPB-UHFFFAOYSA-N
Catalogue number
GC33285
Brand
GLPBIO
Computed properties PubChem CID 134159768 · XLogP 3.3 · TPSA 99 Ų · H-bond donors 1
XLogP
3.3
TPSA
99 Ų
H-bond donors
1
H-bond acceptors
7
Rotatable bonds
5
Heavy atoms
25

SMILES CC1=NOC2=CC(=C(C=C12)NS(=O)(=O)C3=C(C=CC(=C3)Br)OC)OC

Computed descriptors from PubChem (CID 134159768), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

Ordering in Israel

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