Methotrexate Related Compound E

Catalog No. :
ACAHBM509
CAS No. :
70844-48-3
Molecular Formula :
C30H31ClN14O4
Molecular Weight :
687.13

IUPAC Name:4-(((2,4-diaminopteridin-6-yl)methyl)(methyl)amino)benzoic acid hemihydrochloride

Methotrexate Related Compound E structure diagram
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Product Information

Product NameMethotrexate Related Compound E
IUPAC Name4-(((2,4-diaminopteridin-6-yl)methyl)(methyl)amino)benzoic acid hemihydrochloride
Molecular FormulaC30H31ClN14O4
Molecular Weight687.13
SMILESO=C(O)C1=CC=C(N(CC2=NC3=C(N)N=C(N)N=C3N=C2)C)C=C1.O=C(O)C4=CC=C(N(CC5=NC6=C(N)N=C(N)N=C6N=C5)C)C=C4.Cl
InChI KeyWWFYKUISNIJHNQ-UHFFFAOYSA-N
SynonymMethotrexate Related Compound E (50 mg) (4-{[(2,4-Diaminopteridin-6-yl)methyl](methyl)amino}benzoic acid, hemihydrochloride);Methotrexate EP IMpurity E;Methotrexate Related CoMpound E;Methotrexate EP Impurity E (HCl Salt);4-[(2,4-diaminopteridin-6-yl)methyl-methylamino]benzoic acid,hydrochloride;Methotrexate-EP-Imp-E;Methotrexate Impurity 1(Amethopterin Impurity 1);Methotrexate Impurity 5(Methotrexate EP Impurity E)
CAS No.70844-48-3

Synthetic Route by SureRoute

1. ACAHBM509 Molecular Building Block Synthetic Route

Source: SureRouteAuthor: aifchem

  1. ACDTQJ324 route compound structure diagram
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    ACAHBM50970844-48-3
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2. ACAHBM509 Molecular Building Block Synthetic Route

Source: SureRouteAuthor: aifchem

  1. reactant_1 route compound structure diagram
    --
  2. Plus
  3. ACORVW143 route compound structure diagram
    ACORVW14373978-41-3 In Stock
  4. Then
  5. ACAHBM509 route product structure diagram
    ACAHBM50970844-48-3
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