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1260907-17-2,MFCD22417091
Catalog No.:AA000RJ5

1260907-17-2 | 4H-[1,2,4]Triazolo[4,3-a][1,4]benzodiazepine-4-acetamide, 6-(4-chlorophenyl)-N-ethyl-8-methoxy-1-methyl-, (4S)-

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1mg
98+%
in stock  
$13.00   $9.00
- +
2mg
98+%
in stock  
$19.00   $14.00
- +
5mg
98+%
in stock  
$29.00   $21.00
- +
10mg
98+%
in stock  
$45.00   $32.00
- +
50mg
98+%
in stock  
$125.00   $88.00
- +
  • Technical Information
  • Properties
  • Literature
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  • Technical Information
  • Properties
  • Literature
Technical Information
Catalog Number:
AA000RJ5
Chemical Name:
4H-[1,2,4]Triazolo[4,3-a][1,4]benzodiazepine-4-acetamide, 6-(4-chlorophenyl)-N-ethyl-8-methoxy-1-methyl-, (4S)-
CAS Number:
1260907-17-2
Molecular Formula:
C22H22ClN5O2
Molecular Weight:
423.8954
MDL Number:
MFCD22417091
SMILES:
CCNC(=O)C[C@@H]1N=C(c2ccc(cc2)Cl)c2c(n3c1nnc3C)ccc(c2)OC
Properties
Computed Properties
 
Complexity:
639  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
1  
Heavy Atom Count:
30  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
5  
XLogP3:
2.9  

Literature

Title: Inhibition of histone H3K27 demethylases selectively modulates inflammatory phenotypes of natural killer cells.

Journal: The Journal of biological chemistry 20180216

Title: The BET inhibitor JQ1 selectively impairs tumour response to hypoxia and downregulates CA9 and angiogenesis in triple negative breast cancer.

Journal: Oncogene 20170105

Title: MCM5 as a target of BET inhibitors in thyroid cancer cells.

Journal: Endocrine-related cancer 20160401

Title: CCAT1 is an enhancer-templated RNA that predicts BET sensitivity in colorectal cancer.

Journal: The Journal of clinical investigation 20160201

Title: BET inhibitor resistance emerges from leukaemia stem cells.

Journal: Nature 20150924

Title: An epigenomic approach to therapy for tamoxifen-resistant breast cancer.

Journal: Cell research 20140701

Title: Targeting STAT5 in hematologic malignancies through inhibition of the bromodomain and extra-terminal (BET) bromodomain protein BRD2.

Journal: Molecular cancer therapeutics 20140501

Title: Potent antimyeloma activity of the novel bromodomain inhibitors I-BET151 and I-BET762.

Journal: Blood 20140130

Title: Discovery, Design, and Optimization of Isoxazole Azepine BET Inhibitors.

Journal: ACS medicinal chemistry letters 20130912

Title: Optimization of 3,5-dimethylisoxazole derivatives as potent bromodomain ligands.

Journal: Journal of medicinal chemistry 20130425

Title: Cancer research: Open ambition.

Journal: Nature 20120809

Title: From ApoA1 upregulation to BET family bromodomain inhibition: discovery of I-BET151.

Journal: Bioorganic & medicinal chemistry letters 20120415

Title: Fragment-based discovery of bromodomain inhibitors part 2: optimization of phenylisoxazole sulfonamides.

Journal: Journal of medicinal chemistry 20120126

Title: BET bromodomain inhibition as a therapeutic strategy to target c-Myc.

Journal: Cell 20110916

Title: Liver X receptors as regulators of macrophage inflammatory and metabolic pathways.

Journal: Biochimica et biophysica acta 20110801

Title: Discovery and characterization of small molecule inhibitors of the BET family bromodomains.

Journal: Journal of medicinal chemistry 20110609

Title: Suppression of inflammation by a synthetic histone mimic.

Journal: Nature 20101223

Title: Nicodeme E, et al. Suppression of inflammation by a synthetic histone mimic. Nature. 2010 Dec 23;468(7327):1119-23.

Title: Asangani IA, et al. Therapeutic targeting of BET bromodomain proteins in castration-resistant prostate cancer. Nature. 2014 Jun 12;510(7504):278-82.

Title: Chaidos A, et al. Potent antimyeloma activity of the novel bromodomain inhibitors I-BET151 and I-BET762. Blood. 2014 Jan 30;123(5):697-705.

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Tags:1260907-17-2 Molecular Formula|1260907-17-2 MDL|1260907-17-2 SMILES|1260907-17-2 4H-[1,2,4]Triazolo[4,3-a][1,4]benzodiazepine-4-acetamide, 6-(4-chlorophenyl)-N-ethyl-8-methoxy-1-methyl-, (4S)-