Products 112163-39-0

CAS 112163-39-0 appears in our catalog under these names: Methotrexate Impurity 22, 7-Cyanomethotrexate Dimethyl Ester. Offered by: Hubei YoungXin, TRC. Available pack sizes: 10mg, 25mg, 50mg, 100mg, 200mg, 1mg, 2mg, 5mg.

Methotrexate Impurity 22
Hubei YoungXin
  • size: 10mg, 25mg, 50mg, 100mg
  • Variants: 5
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7-Cyanomethotrexate Dimethyl Ester
TRC
  • size: 1mg, 2mg, 5mg
  • Variants: 3
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Structural formula: {0} (CAS {1})

Dimethyl (2S)-2-[[4-[(2,4-diamino-7-cyanopteridin-6-yl)methyl-methylamino]benzoyl]amino]pentanedioate (CAS 112163-39-0) is a chemical compound with the molecular formula C23H25N9O5 and a molecular weight of 507.5 g/mol. IUPAC name: dimethyl (2S)-2-[[4-[(2,4-diamino-7-cyanopteridin-6-yl)methyl-methylamino]benzoyl]amino]pentanedioate. InChIKey: IELAPFQSSXNBBQ-AWEZNQCLSA-N.

Identity
Molecular formulaC23H25N9O5
Molecular weight507.5 g/mol
IUPAC namedimethyl (2S)-2-[[4-[(2,4-diamino-7-cyanopteridin-6-yl)methyl-methylamino]benzoyl]amino]pentanedioate
InChIKeyIELAPFQSSXNBBQ-AWEZNQCLSA-N
SMILESCN(CC1=C(N=C2C(=N1)C(=NC(=N2)N)N)C#N)C3=CC=C(C=C3)C(=O)N[C@@H](CCC(=O)OC)C(=O)OC

Computed by PubChem (NCBI)

Synonyms: 7-Cyanomethotrexate Dimethyl Ester
Related forms of this compound
dimethyl (2S)-2-[[4-[(2,4-diamino-7-cyanopteridin-6-yl)methyl-(trideuteriomethyl)amino]benzoyl]amino]pentanedioate C23H25N9O5