ChemicalBook--->CAS DataBase List--->93987-29-2

93987-29-2

93987-29-2 Structure

93987-29-2 Structure
IdentificationBack Directory
[Name]

BI 6015
[CAS]

93987-29-2
[Synonyms]

BI 6015
2-Methyl-1-[(2-methyl-5-nitrophenyl)sulfonyl]-1H-benzimidazole
2-Methyl-1-(2-methyl-5-nitrophenylsulfonyl)-1H-benzo[d]imidazole
[Molecular Formula]

C15H13N3O4S
[MDL Number]

MFCD04406654
[MOL File]

93987-29-2.mol
[Molecular Weight]

331.35
Chemical PropertiesBack Directory
[Boiling point ]

570.6±60.0 °C(Predicted)
[density ]

1.45±0.1 g/cm3(Predicted)
[storage temp. ]

+2C to +8C
[solubility ]

Soluble in DMSO (up to 25 mg/ml) or in Ethanol (up to 10 mg/ml).
[form ]

Beige powder
[pka]

0.88±0.10(Predicted)
[color ]

Tan
[Stability:]

Stable for 1 year from date of purchase as supplied. Solutions in DMSO or ethanol may be stored at -20° for up to 2 months.
[InChI]

InChI=1S/C15H13N3O4S/c1-10-7-8-12(18(19)20)9-15(10)23(21,22)17-11(2)16-13-5-3-4-6-14(13)17/h3-9H,1-2H3
[InChIKey]

ILVCPQPMRPHZSG-UHFFFAOYSA-N
[SMILES]

C1(C)N(S(C2=CC([N+]([O-])=O)=CC=C2C)(=O)=O)C2=CC=CC=C2N=1
Safety DataBack Directory
[WGK Germany ]

WGK 2
[Storage Class]

11 - Combustible Solids
Hazard InformationBack Directory
[Description]

BI-6015 (93987-29-2) is a hepatocyte nuclear factor 4α (HNF4α) antagonist. HNF4α is a central regulator of gene expression in cell types that play a central role in metabolic homeostasis.1 BI-6015 binds to HNF4α with high affinity and modulates the expression of known target genes. It was shown to be selectively cytotoxic to cancer cell lines in vitro and in vivo however in vivo potency was limited by suboptimal pharmacokinetics.2 BI-6015 represents the first small molecule tool for pharmacologic modulation of HNF4α activity.2 Cell permeable.
[Uses]

BI 6015 is a known HNF4α antagonist that represses the expression of known HNF4α target genes. Studies have shown that BI6015 are also capable of exhibiting selective cytotoxic activities against numerous tumor cell lines.
[in vivo]

BI-6015 (10-30 mg/kg; i.p. once daily for 5 days) induces loss of HNF4α expression and hepatic steatosis in mice[1].
BI-6015 (10-30 mg/kg; i.p. daily or every other day for 20-57 days) induces apoptosis in a human hepatocellular carcinoma mouse model[1].

[storage]

Store at -20°C
[References]

1) Wang et al. (2000), Hepatocyte Nuclear Factor 4α Regulates the Expression of Pancreatic β-Cell Genes Implicated in Glucose Metabolism and Nutrient-induced Insulin Secretion; J. Biol. Chem., 275 35953 2) Kiselyuk et al. (2012), HNF4α antagonists discovered by a high-throughput screen for modulators of the human insulin promotor; Chem. Biol., 19 806
Spectrum DetailBack Directory
[Spectrum Detail]

BI 6015(93987-29-2)1HNMR
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