Baricitinib Impurity 29

Basic Information

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CAS Number

1187595-90-9

Molecular Formula

C22H27N7O4S

Molecular Weight

485.56 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Esters

Basic Chemical Raw Materials Organic Chemicals Ethers

Basic Chemical Raw Materials Organic Chemicals Nitriles

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Fine Chemicals Dyes and Pigments Organic Dyes

Fine Chemicals Surfactants Anionic Surfactants

Laboratory Chemicals Research Chemicals Biochemical Reagents

Basic Physical Properties

SMILES

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N#CCC1(CN(C1)S(=O)(=O)CC)n1ncc(c1)c1ncnc2c1ccn2COC(=O)C(C)(C)C

InChI

InChI=1S/H3N/h1H3

InChIKey

QGZKDVFQNNGYKY-UHFFFAOYSA-N

LogP

0.16199999999999998

Topological Polar Surface Area

35.0 Å²

Hydrogen Bond Donor/Acceptor

3 / 1

Complexity

916

Synonyms & References

English

(4-(1-(3-(Cyanomethyl)-1-(ethylsulfonyl)azetidin-3-yl)-1H-pyrazol-4-yl)-7H-pyrrolo[2,3-d]pyrimidin-7-yl)methyl pivalate
[4-[1-[3-(cyanomethyl)-1-ethylsulfonylazetidin-3-yl]pyrazol-4-yl]pyrrolo[2,3-d]pyrimidin-7-yl]methyl 2,2-dimethylpropanoate
AMY9144
BCP34619

FAQ

What is Baricitinib Impurity 29 (CAS: 1187595-90-9)?

Baricitinib Impurity 29 (CAS: 1187595-90-9) is a byproduct found in the manufacturing process of baricitinib, a Janus kinase (JAK) inhibitor used for treating rheumatoid arthritis and certain types of pneumonia. It is a complex organic compound with a specific molecular structure that plays a minor role in the overall compound but is managed to ensure product quality and safety.

What are the main uses of Baricitinib Impurity 29 (CAS: 1187595-90-9)?

Baricitinib Impurity 29 (CAS: 1187595-90-9) is primarily managed and monitored during the synthesis process of baricitinib for pharmaceutical applications. It is not used independently but is important for ensuring the quality and purity of the final drug product.

Is Baricitinib Impurity 29 (CAS: 1187595-90-9) safe?

Baricitinib Impurity 29 (CAS: 1187595-90-9) is generally considered safe when managed as a controlled byproduct during the production of baricitinib. However, it should be handled with appropriate safety measures, including the use of personal protective equipment (PPE) and proper ventilation.

How should Baricitinib Impurity 29 (CAS: 1187595-90-9) be stored?

Baricitinib Impurity 29 (CAS: 1187595-90-9) should be stored in a cool, dry place, away from direct sunlight and heat sources. It should be kept in a tightly sealed container to prevent degradation. Optimal storage conditions are typically between 2°C and 8°C (36°F to 46°F) to ensure stability and safety.