3-PiperidinaMine, 1-acetyl-N,4-diMethyl-N-1H-pyrrolo[2,3-d]pyriMidin-4-yl-, (3R,4R)(9CI) is a complex organic compound with a unique molecular structure. It is characterized by its piperidine and pyrrolo[2,3-d]pyrimidine moieties, which contribute to its chemical properties and potential applications. 3-PiperidinaMine, 1-acetyl-N,4-diMethyl-N-1H-pyrrolo[2,3-d]pyriMidin-4-yl-, (3R,4R)(9CI) is an impurity of Tofacitinib, a Janus kinase 3 (Jak3) inhibitor, and is involved in the inhibition of selected members of the STE7 and STE20 subfamily of kinases.
477600-76-3
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Basic information
- Product Name: 3-PiperidinaMine, 1-acetyl-N,4-diMethyl-N-1H-pyrrolo[2,3-d]pyriMidin-4-yl-, (3R,4R)- (9CI)
- Synonyms: 3-PiperidinaMine, 1-acetyl-N,4-diMethyl-N-1H-pyrrolo[2,3-d]pyriMidin-4-yl-, (3R,4R)- (9CI);Tofacitinib Impurity Z;Tofacitinib Impurity 4;Tofacitinib Impurity 33;Tofacitinib Impurity 46;1-((3R,4R)-4-methyl-3-(methyl(7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino)piperidin-1-yl)ethanone;1-((3R,4R)-4-Methyl-3-(methyl(7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino)piperidin-1-yl)ethan-1-one;1-[(3R,4R)-4-Methyl-3-(methyl-7H-pyrrolo[2,3-d]pyrimidin-4-ylamino)-1-piperidinyl]ethanone
- CAS NO:477600-76-3
- Molecular Formula: C15H22N5O
- Molecular Weight: 288.36808
- EINECS: N/A
- Product Categories: N/A
- Mol File: 477600-76-3.mol
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Chemical Properties
- Melting Point: N/A
- Boiling Point: N/A
- Flash Point: N/A
- Appearance: /
- Density: N/A
- Refractive Index: N/A
- Storage Temp.: Refrigerator
- Solubility: Chloroform (Slightly), Methanol (Slightly)
- CAS DataBase Reference: 3-PiperidinaMine, 1-acetyl-N,4-diMethyl-N-1H-pyrrolo[2,3-d]pyriMidin-4-yl-, (3R,4R)- (9CI)(CAS DataBase Reference)
- NIST Chemistry Reference: 3-PiperidinaMine, 1-acetyl-N,4-diMethyl-N-1H-pyrrolo[2,3-d]pyriMidin-4-yl-, (3R,4R)- (9CI)(477600-76-3)
- EPA Substance Registry System: 3-PiperidinaMine, 1-acetyl-N,4-diMethyl-N-1H-pyrrolo[2,3-d]pyriMidin-4-yl-, (3R,4R)- (9CI)(477600-76-3)
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Safety Data
- Hazard Codes: N/A
- Statements: N/A
- Safety Statements: N/A
- WGK Germany:
- RTECS:
- HazardClass: N/A
- PackingGroup: N/A
- Hazardous Substances Data: 477600-76-3(Hazardous Substances Data)
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477600-76-3 Usage
Uses
Used in Pharmaceutical Industry:3-PiperidinaMine, 1-acetyl-N,4-diMethyl-N-1H-pyrrolo[2,3-d]pyriMidin-4-yl-, (3R,4R)(9CI) is used as an impurity in the development and production of Tofacitinib (T528000), a Janus kinase 3 (Jak3) inhibitor. Its presence in the drug may affect the overall efficacy and safety profile of the medication, making it an important compound to study and control during the drug development process.
Used in Research and Development:
In the field of research and development, 3-PiperidinaMine, 1-acetyl-N,4-diMethyl-N-1H-pyrrolo[2,3-d]pyriMidin-4-yl-, (3R,4R)(9CI) serves as a valuable compound for studying the structure-activity relationships of Janus kinase inhibitors. Understanding its interactions with the STE7 and STE20 subfamily of kinases can provide insights into the design and optimization of novel therapeutic agents targeting these kinases.
Used in Quality Control and Regulatory Compliance:
3-PiperidinaMine, 1-acetyl-N,4-diMethyl-N-1H-pyrrolo[2,3-d]pyriMidin-4-yl-, (3R,4R)(9CI) is also used in the quality control and regulatory compliance of Tofacitinib. Ensuring that the levels of this impurity are within acceptable limits is crucial for maintaining the safety and efficacy of the drug, as well as meeting regulatory requirements for pharmaceutical products.
Check Digit Verification of cas no
The CAS Registry Mumber 477600-76-3 includes 9 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 6 digits, 4,7,7,6,0 and 0 respectively; the second part has 2 digits, 7 and 6 respectively.Calculate Digit Verification of CAS Registry Number 477600-76:
(8*4)+(7*7)+(6*7)+(5*6)+(4*0)+(3*0)+(2*7)+(1*6)=173
173 % 10 = 3
So 477600-76-3 is a valid CAS Registry Number.
477600-76-3Upstream product
477600-76-3Downstream Products
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3-PiperidinaMine, 1-acetyl-N,4-diMethyl-N-1H-pyrrolo[2,3-d]pyriMidin-4-yl-, (3R,4R)- (9CI)
