ChemicalBook--->CAS DataBase List--->1012788-65-6

1012788-65-6

1012788-65-6 Structure

1012788-65-6 Structure
IdentificationBack Directory
[Name]

CAY10607
[CAS]

1012788-65-6
[Synonyms]

CAY10607
CAY10607 Exclusive
Benzisoxazole Hsp90 Inhibitor
1,3-Benzenediol, 4-chloro-6-[5-[[2-(4-morpholinyl)ethyl]amino]-1,2-benzisoxazol-3-yl]-
[Molecular Formula]

C19H20ClN3O4
[MDL Number]

MFCD18382085
[MOL File]

1012788-65-6.mol
[Molecular Weight]

389.83
Chemical PropertiesBack Directory
[storage temp. ]

Store at -20°C
[solubility ]

DMF: 20 mg/ml; DMSO: 20 mg/ml; Ethanol: 25 mg/ml; Ethanol:PBS (pH 7.2) (1:10): 0.1 mg/ml
[form ]

A crystalline solid
Hazard InformationBack Directory
[Description]

Benzisoxazole Hsp90 inhibitor is an inhibitor of heat shock protein 90 (Hsp90; IC50 = 30 nM in a fluorescence polarization assay). It is selective for Hsp90 over a panel of kinases (IC50s = >20 μM). Benzisoxazole Hsp90 inhibitor inhibits the proliferation of HCT116, SK-BR-3, LNCaP, DU145, and H157 cancer cells (IC50s = 0.28, 0.37, 0.17, 0.29, and 0.23 μM, respectively). It also induces degradation of the Hsp90 targets HER2 and the androgen receptor in SK-BR-3 and LNCaP cells, respectively, with an IC50 value of 0.33 μM for both.
[Uses]

Benzisoxazole Hsp90 Inhibitor is an inhibitor that binds to the N-terminal domain of Hsp90.
[Definition]

ChEBI: 4-chloro-6-{5-[(2-morpholin-4-ylethyl)amino]-1,2-benzisoxazol-3-yl}benzene-1,3-diol is a member of the class of 1,2-benzoxazoles carrying 2,4-dihydroxy-4-chlorophenyl and (2-morpholin-4-ylethyl)amino substituents at positions 3 and 5 respectively. It has a role as a Hsp90 inhibitor. It is a member of 1,2-benzoxazoles, a member of morpholines, a member of resorcinols, a member of monochlorobenzenes, a tertiary amino compound, a secondary amino compound and an aromatic amine.
[IC 50]

HSP90: 30 nM (IC50)
[References]

[1] ARIAMALA GOPALSAMY*. Discovery of Benzisoxazoles as Potent Inhibitors of Chaperone Heat Shock Protein 90[J]. Journal of Medicinal Chemistry, 2008, 51 3: 373-375. DOI: 10.1021/jm701385c
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