CAS 1561178-17-3

5-Bromo-7-[5-deoxy-5-[[3-[[[[4-(1,1-dimethylethyl)phenyl]amino]carbonyl]amino]propyl](1-methylethyl)amino]-β-D-ribofuranosyl]-7H-pyrrolo[2,3-d]pyrimidin-4-amine

Description:

5-Bromo-7-[5-deoxy-5-[[3-[[[[4-(1,1-dimethylethyl)phenyl]amino]carbonyl]amino]propyl](1-methylethyl)amino]-β-D-ribofuranosyl]-7H-pyrrolo[2,3-d]pyrimidin-4-amine, with CAS number 1561178-17-3, is a complex organic compound characterized by its intricate molecular structure, which includes a pyrrolo[2,3-d]pyrimidine core. This compound features multiple functional groups, including bromine, amine, and carbonyl groups, contributing to its potential biological activity. The presence of a ribofuranosyl moiety suggests that it may interact with biological systems, possibly influencing nucleic acid metabolism or enzyme activity. Its bulky substituents, such as the tert-butyl group, may affect its solubility and permeability, which are critical for pharmacological applications. The compound's synthesis and characterization would typically involve advanced organic chemistry techniques, and its stability, reactivity, and potential therapeutic uses would be of interest in medicinal chemistry research. Overall, this compound exemplifies the complexity often found in drug-like molecules, highlighting the interplay between structure and biological function.

Formula: C₂₈H₄₀BrN₇O₄

InChI: InChI=1S/C28H40BrN7O4/c1-16(2)35(12-6-11-31-27(39)34-18-9-7-17(8-10-18)28(3,4)5)14-20-22(37)23(38)26(40-20)36-13-19(29)21-24(30)32-15-33-25(21)36/h7-10,13,15-16,20,22-23,26,37-38H,6,11-12,14H2,1-5H3,(H2,30,32,33)(H2,31,34,39)/t20-,22-,23-,26-/m1/s1

InChI key: InChIKey=IQCKJUKAQJINMK-HUBRGWSESA-N

SMILES: O[C@H]1[C@H](N2C=3C(C(Br)=C2)=C(N)N=CN3)O[C@H](CN(CCCNC(NC4=CC=C(C(C)(C)C)C=C4)=O)C(C)C)[C@H]1O

Synonyms:

• 5-Bromo-7-[5-deoxy-5-[[3-[[[[4-(1,1-dimethylethyl)phenyl]amino]carbonyl]amino]propyl](1-methylethyl)amino]-β-D-ribofuranosyl]-7H-pyrrolo[2,3-d]pyrimidin-4-amine
• SGC 0946
• 7H-Pyrrolo[2,3-d]pyrimidin-4-amine, 5-bromo-7-[5-deoxy-5-[[3-[[[[4-(1,1-dimethylethyl)phenyl]amino]carbonyl]amino]propyl](1-methylethyl)amino]-β-D-ribofuranosyl]-

7H-Pyrrolo[2,3-d]pyrimidin-4-amine, 5-bromo-7-[5-deoxy-5-[[3-[[[[4-(1,1-dimethylethyl)phenyl]amino]carbonyl]amino]propyl](1-methylethyl)amino]-β-D-ribofuranosyl]-

CAS: 1561178-17-3

Formula: C₂₈H₄₀BrN₇O₄

Purity: 99%

Color and Shape: Solid

Molecular weight: 618.5657

Ref: IN-DA001OIS

SGC0946

CAS: 1561178-17-3

SGC0946

Purity: ≥98%

Molecular weight: 618.57g/mol

Ref: 54-BUP05868

SGC0946

CAS: 1561178-17-3

SGC0946 is a highly effective and specific DOT1L methyltransferase inhibitor (IC50: 0.3 nM); selectively kill mixed lineage leukemia cells.

Formula: C₂₈H₄₀BrN₇O₄

Purity: 98% - 99.82%

Color and Shape: Solid

Molecular weight: 618.57

Ref: TM-T3082

1-(3-((((2R,3S,4R,5R)-5-(4-Amino-5-bromo-7H-pyrrolo[2,3-d]pyrimidin-7-yl)-3,4-dihydroxytetrahydrofuran-2-yl)methyl)(isopropyl)amino)propyl)-3-(4-(tert-butyl)phenyl)urea

CAS: 1561178-17-3

Purity: 99%

Molecular weight: 618.5770264

Ref: 10-F870105

SGC-0946

Controlled Product

CAS: 1561178-17-3

Applications SGC0946 is a potent DOT1L methyltransferase inhbiitor used in the treatment of leukemia seen effectively in vitro.
References Yu, W. et al.: Nat. Commun., 3, 1288 (2012);

Formula: C₂₈H₄₀BrN₇O₄

Color and Shape: Neat

Molecular weight: 618.57

Ref: TR-S282300

SGC0946

CAS: 1561178-17-3

SGC0946 is a methyltransferase inhibitor that inhibits the methylation of DNA by inhibiting the activity of DNA methyltransferase. It is being developed for use in regenerative medicine to inhibit transcriptional regulation and pluripotent cells. SGC0946 has been shown to be effective in inhibiting cell factor and human serum methyltransferase, which are responsible for the production of monocytes. SGC0946 also inhibits the production of cytokines, such as IL-1β, IL-6, and TNF-α, as well as chemokines such as RANTES and MCP-1. This drug also inhibits the growth of infectious diseases such as HIV-1 and HCV by disrupting dna methylation.

Formula: C₂₈H₄₀BrN₇O₄

Purity: Min. 95%

Molecular weight: 618.57 g/mol

Ref: 3D-BS174968