CAS 1268524-71-5

1,1-Dimethylethyl (6R)-4-(4-chlorophenyl)-2,3,9-trimethyl-6H-thieno[3,2-f][1,2,4]triazolo[4,3-a][1,4]diazepine-6-acetate

Description:

1,1-Dimethylethyl (6R)-4-(4-chlorophenyl)-2,3,9-trimethyl-6H-thieno[3,2-f][1,2,4]triazolo[4,3-a][1,4]diazepine-6-acetate, identified by its CAS number 1268524-71-5, is a complex organic compound characterized by its unique structural features, including a thieno-triazolo-diazepine framework. This compound exhibits a range of functional groups, including an acetate moiety and a chlorophenyl substituent, which may influence its chemical reactivity and biological activity. The presence of multiple methyl groups contributes to its steric bulk, potentially affecting its interaction with biological targets. The stereochemistry indicated by the (6R) designation suggests specific spatial arrangements that could be crucial for its pharmacological properties. Such compounds are often investigated for their potential therapeutic applications, particularly in the fields of medicinal chemistry and drug development. The intricate structure and diverse functional groups may also provide insights into its solubility, stability, and reactivity, making it a subject of interest for further research in chemical and pharmaceutical sciences.

Formula: C₂₃H₂₅ClN₄O₂S

InChI: InChI=1S/C23H25ClN4O2S/c1-12-13(2)31-22-19(12)20(15-7-9-16(24)10-8-15)25-17(11-18(29)30-23(4,5)6)21-27-26-14(3)28(21)22/h7-10,17H,11H2,1-6H3/t17-/m1/s1

InChI key: InChIKey=DNVXATUJJDPFDM-QGZVFWFLSA-N

SMILES: CC=1C2=C(N3C([C@@H](CC(OC(C)(C)C)=O)N=C2C4=CC=C(Cl)C=C4)=NN=C3C)SC1C

Synonyms:

• 1,1-Dimethylethyl (6R)-4-(4-chlorophenyl)-2,3,9-trimethyl-6H-thieno[3,2-f][1,2,4]triazolo[4,3-a][1,4]diazepine-6-acetate
• (R)-(-)-tert-Butyl 2-(4-(4-chlorophenyl)-2,3,9-trimethyl-6H-thieno[3,2-f][1,2,4]triazolo[4,3-a][1,4]diazepin-6-yl)acetate
• JQ 1(-)
• 6H-Thieno[3,2-f][1,2,4]triazolo[4,3-a][1,4]diazepine-6-acetic acid, 4-(4-chlorophenyl)-2,3,9-trimethyl-, 1,1-dimethylethyl ester, (6R)-
• (-)-JQ 1

6H-Thieno[3,2-f][1,2,4]triazolo[4,3-a][1,4]diazepine-6-acetic acid, 4-(4-chlorophenyl)-2,3,9-trimethyl-, 1,1-dimethylethyl ester, (6R)-

CAS: 1268524-71-5

Formula: C₂₃H₂₅ClN₄O₂S

Purity: 98%

Color and Shape: Solid

Molecular weight: 456.9882

Ref: IN-DA000TCY

Tert-Butyl (R)-2-(4-(4-Chlorophenyl)-2,3,9-Trimethyl-6H-Thieno[3,2-F][1,2,4]Triazolo[4,3-A][1,4]Diazepin-6-Yl)Acetate

CAS: 1268524-71-5

Tert-Butyl (R)-2-(4-(4-Chlorophenyl)-2,3,9-Trimethyl-6H-Thieno[3,2-F][1,2,4]Triazolo[4,3-A][1,4]Diazepin-6-Yl)Acetate

Purity: 98%

Molecular weight: 456.99g/mol

Ref: 54-OR1023358

(R)-(-)-JQ1 Enantiomer

CAS: 1268524-71-5

(R)-(-)-JQ1 Enantiomer

Purity: ≥98%

Molecular weight: 456.99g/mol

Ref: 54-BUP10663

(R)-(-)-JQ1 Enantiomer

CAS: 1268524-71-5

(R)-(-)-JQ1 Enantiomer is the stereoisomer of (+)-JQ1. (+)-JQ1 is a BET bromodomain inhibitor, acting on BRD4(1/2)(IC50 of 77 nM/33 nM in a cell-free assay)

Formula: C₂₃H₂₅ClN₄O₂S

Purity: 99.38%

Color and Shape: Solid

Molecular weight: 456.99

Ref: TM-T19618

(R)-(-)-tert-Butyl 2-(4-(4-Chlorophenyl)-2,3,9-trimethyl-6H-thieno[3,2-f][1,2,4]triazolo[4,3-a][1,4]diazepin-6-yl)acetate

Controlled Product

CAS: 1268524-71-5

Formula: C₂₃H₂₅ClN₄O₂S

Color and Shape: Neat

Molecular weight: 456.988

Ref: TR-T117585

(-)-JQ1

Controlled Product

CAS: 1268524-71-5

(-)-JQ1 is a small molecule inhibitor of the CDK4/6 complex that has been shown to be synergistic with palbociclib for the treatment of hematological malignancies. (-)-JQ1 has also been shown to inhibit proliferation and induce apoptosis in multiple myeloma cells, which may be due to its ability to bind to the bromodomain and interfere with transcriptional activity. (-)-JQ1 is a pan-histone deacetylase inhibitor that can cause dose-dependent changes in gene expression. It targets proapoptotic genes such as Bim and Bmf, while upregulating antiapoptotic genes such as p21 and Mcl-1. (-)-JQ1 is an analog of JQ1, which was originally discovered by screening a synthetic compound library for inhibitors of histone acetylation.

Formula: C₂₃H₂₅ClN₄O₂S

Purity: Min. 95%

Molecular weight: 456.99 g/mol

Ref: 3D-TAC52471