Tofacitinib Impurity 4

cas: 2504210-38-0 — see every product listed under this CAS number, including other names

Tofacitinib Impurity 4 (CAS 2504210-38-0) is a chemical reagent available from Chemat. Available pack sizes: on request. Offered by: Chemat Brand.

brandChemat Brand
catalog numberAO-T0086.05
cas2504210-38-0
sizeon request
availability In stock
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properties

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purityNo data
Structural formula: {0} (CAS {1})

N-methyl-N-[(3R,4R)-4-methyl-1-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)piperidin-3-yl]-7H-pyrrolo[2,3-d]pyrimidin-4-amine (CAS 2504210-38-0) is a chemical compound with the molecular formula C19H22N8 and a molecular weight of 362.4 g/mol. IUPAC name: N-methyl-N-[(3R,4R)-4-methyl-1-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)piperidin-3-yl]-7H-pyrrolo[2,3-d]pyrimidin-4-amine. InChIKey: SMRQHAISNZVPQG-DOMZBBRYSA-N.

Identity
Molecular formulaC19H22N8
Molecular weight362.4 g/mol
IUPAC nameN-methyl-N-[(3R,4R)-4-methyl-1-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)piperidin-3-yl]-7H-pyrrolo[2,3-d]pyrimidin-4-amine
InChIKeySMRQHAISNZVPQG-DOMZBBRYSA-N
SMILESC[C@@H]1CCN(C[C@@H]1N(C)C2=NC=NC3=C2C=CN3)C4=NC=NC5=C4C=CN5

Computed by PubChem (NCBI)

Isomers (same molecular formula)
N-methyl-N-[(3R,4R)-4-methylpiperidin-3-yl]-7-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)pyrrolo[2,3-d]pyrimidin-4-amine C19H22N8

Also listed as

Tofacitinib Impurity 29 Chemat Brand CAS 2504210-38-0
N-Methyl-N-((3R,4R)-4-methyl-1-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)piperidin-3-yl)-7H-pyrrolo[2,3-d]pyrimidin-4-amine, 98% Chemat Brand CAS 2504210-38-0