917392-54-2

  • Product Name:4-Methyl-3-[[4-(3-pyridinyl)-2-pyrimidinyl]amino]benzoic acid methyl ester
  • Molecular Formula:C18H16 N4 O2
  • Purity:99%
  • Molecular Weight:320.351
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Product Details

Chinese Factory Supply Buy Quality 4-Methyl-3-[[4-(3-pyridinyl)-2-pyrimidinyl]amino]benzoic acid methyl ester 917392-54-2 with Fast Shipping

  • Molecular Formula:C18H16 N4 O2
  • Molecular Weight:320.351
  • Vapor Pressure:0mmHg at 25°C 
  • Melting Point:148 - 150°C 
  • Boiling Point:538.59oC at 760 mmHg 
  • PKA:2.70±0.12(Predicted) 
  • Flash Point:279.53oC 
  • PSA:77.00000 
  • Density:1.258 
  • LogP:3.45020 

4-Methyl-3-[[4-(3-pyridinyl)-2-pyrimidinyl]amino]benzoic acid methyl ester(Cas 917392-54-2) Usage

Uses

Methyl 4-methyl-3-[[4-(pyridin-3-yl)pyrimidin-2-yl]amino]benzoate is an intermediate used in the synthesis of 4-Methyl-3-[[4-(3-pyridinyl)-2-pyrimidinyl]amino]benzamide (M326838), which is an impurity of Nilotinib (N465300), a possible agent in the treatment of chronic myelogenous leukemia.

InChI:InChI=1/C18H16N4O2/c1-12-5-6-13(17(23)24-2)10-16(12)22-18-20-9-7-15(21-18)14-4-3-8-19-11-14/h3-11H,1-2H3,(H,20,21,22)

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917392-54-2 Process route

3-guanidino-4-methylbenzoic acid methyl ester
1025716-98-6

3-guanidino-4-methylbenzoic acid methyl ester

3-(N,N-dimethylamino)-1-(pyridin-3-yl)prop-2-en-1-one
55314-16-4,75415-01-9,123367-26-0

3-(N,N-dimethylamino)-1-(pyridin-3-yl)prop-2-en-1-one

4-methyl-3-{[4-(pyridin-3-yl)pyrimidin-2-yl]amino}benzoic acid
641569-94-0

4-methyl-3-{[4-(pyridin-3-yl)pyrimidin-2-yl]amino}benzoic acid

methyl 4-methyl-3 -[[4-(pyridin-3-yl)pyrimidin-2-yl]amino]benzoate
917392-54-2

methyl 4-methyl-3 -[[4-(pyridin-3-yl)pyrimidin-2-yl]amino]benzoate

Conditions
Conditions Yield
3-guanidino-4-methylbenzoic acid methyl ester; 3-(N,N-dimethylamino)-1-(pyridin-3-yl)prop-2-en-1-one; With sodium hydroxide; ethanol; for 16h; Heating / reflux;
With hydrogenchloride; water; pH=~ 3 - 4;
 
methyl 3-bromo-4-methylbenzoate
104901-43-1

methyl 3-bromo-4-methylbenzoate

4-pyridin-3-ylpyrimidin-2-ylamine
66521-66-2

4-pyridin-3-ylpyrimidin-2-ylamine

methyl 4-methyl-3 -[[4-(pyridin-3-yl)pyrimidin-2-yl]amino]benzoate
917392-54-2

methyl 4-methyl-3 -[[4-(pyridin-3-yl)pyrimidin-2-yl]amino]benzoate

Conditions
Conditions Yield
With C43H63ClNO2PPd; caesium carbonate; In 1,4-dioxane; at 120 ℃; for 1.5h; Inert atmosphere;
95%
With chloro[2-(dicyclohexylphosphino)-3,6-dimethoxy-2′,4′,6′-tri-1-propyl-1,1′-biphenyl][2-(2-aminoethyl)phenyl]palladium(II); caesium carbonate; In 1,4-dioxane; at 120 ℃; for 1.5h; Inert atmosphere;
81%

917392-54-2 Upstream products

  • 1025716-99-7
    1025716-99-7

    3-[(aminoiminomethyl)amino]-4-methylbenzoic acid methylester mononitrate

  • 55314-16-4
    55314-16-4

    (E)-3-(dimethylamino)-1-(pyridin-3-yl)prop-2-en-1-one

  • 55314-16-4
    55314-16-4

    3-(N,N-dimethylamino)-1-(pyridin-3-yl)prop-2-en-1-one

  • 1025716-98-6
    1025716-98-6

    3-guanidino-4-methylbenzoic acid methyl ester

917392-54-2 Downstream products

  • 641571-10-0
    641571-10-0

    nilotinib

  • 641569-94-0
    641569-94-0

    4-methyl-3-{[4-(pyridin-3-yl)pyrimidin-2-yl]amino}benzoic acid

  • 1205540-16-4
    1205540-16-4

    N-(3-bromo-5-(trifluoromethyl)phenyl)-4-methyl-3-((4-(pyridin-3-yl)pyrimidin-2-yl)amino)benzamide

  • 1186619-20-4
    1186619-20-4

    4-methyl-3-[[4-(3-pyridinyl)-2-pyrimidinyl]amino]benzoic acid N'-4-[[(4-methyl-1-piperazinyl)methyl]benzoyl]hydrazide

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