propyl 3-[3-({[4-({[4-(aminomethyl)cyclohexyl]methyl}amino)-5-nitropyrimidin-2-yl]amino}methyl)-2-methylphenyl]benzoate

Base Information

Chemical Name:propyl 3-[3-({[4-({[4-(aminomethyl)cyclohexyl]methyl}amino)-5-nitropyrimidin-2-yl]amino}methyl)-2-methylphenyl]benzoate
CAS No.:1412438-40-4
Molecular Formula:C₃₀H₃₈N₆O₄
Molecular Weight:546.67
Hs Code.:

Synonyms:propyl 3-[3-({[4-({[4-(aminomethyl)cyclohexyl]methyl}amino)-5-nitropyrimidin-2-yl]amino}methyl)-2-methylphenyl]benzoate

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Chemical Property of propyl 3-[3-({[4-({[4-(aminomethyl)cyclohexyl]methyl}amino)-5-nitropyrimidin-2-yl]amino}methyl)-2-methylphenyl]benzoate

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Technology Process of propyl 3-[3-({[4-({[4-(aminomethyl)cyclohexyl]methyl}amino)-5-nitropyrimidin-2-yl]amino}methyl)-2-methylphenyl]benzoate

There total 7 articles about propyl 3-[3-({[4-({[4-(aminomethyl)cyclohexyl]methyl}amino)-5-nitropyrimidin-2-yl]amino}methyl)-2-methylphenyl]benzoate which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 38.0%

: 71-23-8
propan-1-ol

: 1412438-58-4
3'-[(4-{[trans-4-(tert-butoxycarbonylamino-methyl)-cyclohexylmethyl]-amino}-5-nitro-pyrimidin-2-ylamino)-methyl]-2'-methyl-biphenyl-3-carboxylic acid

: 1412438-40-4
propyl 3-[3-({[4-({[4-(aminomethyl)cyclohexyl]methyl}amino)-5-nitropyrimidin-2-yl]amino}methyl)-2-methylphenyl]benzoate

Guidance literature:: propan-1-ol; 3'-[(4-{[trans-4-(tert-butoxycarbonylamino-methyl)-cyclohexylmethyl]-amino}-5-nitro-pyrimidin-2-ylamino)-methyl]-2'-methyl-biphenyl-3-carboxylic acid; With benzotriazol-1-ol; 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride; triethylamine; In N,N-dimethyl-formamide; at 30 ℃;

With trifluoroacetic acid; In dichloromethane; at 30 ℃; for 2h;

Reference yield:

: 76006-33-2
3-bromo-2-methylbenzoic acid

: 1412438-40-4
propyl 3-[3-({[4-({[4-(aminomethyl)cyclohexyl]methyl}amino)-5-nitropyrimidin-2-yl]amino}methyl)-2-methylphenyl]benzoate

Guidance literature:: Multi-step reaction with 6 steps

1.1: N-ethyl-N,N-diisopropylamine; 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride; benzotriazol-1-ol; ammonium chloride / N,N-dimethyl-formamide / 20 °C

2.1: dimethylsulfide borane complex / Reflux

2.2: 0.17 h / 20 °C

2.3: 1 h / 20 °C

3.1: triethylamine / ethanol / 20 °C

4.1: N,N-dimethyl-formamide / 20 °C

5.1: sodium carbonate / tetrakis(triphenylphosphine) palladium⁽⁰⁾ / 1,4-dioxane; water / 100 °C / Inert atmosphere

6.1: triethylamine; 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride; benzotriazol-1-ol / N,N-dimethyl-formamide / 30 °C

6.2: 2 h / 30 °C

With dimethylsulfide borane complex; sodium carbonate; ammonium chloride; benzotriazol-1-ol; 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride; triethylamine; N-ethyl-N,N-diisopropylamine; tetrakis(triphenylphosphine) palladium⁽⁰⁾; In 1,4-dioxane; ethanol; water; N,N-dimethyl-formamide;

Reference yield:

: 919363-09-0
3-bromo-2-methylbenzamide

: 1412438-40-4
propyl 3-[3-({[4-({[4-(aminomethyl)cyclohexyl]methyl}amino)-5-nitropyrimidin-2-yl]amino}methyl)-2-methylphenyl]benzoate

Guidance literature:: Multi-step reaction with 5 steps

1.1: dimethylsulfide borane complex / Reflux

1.2: 0.17 h / 20 °C

1.3: 1 h / 20 °C

2.1: triethylamine / ethanol / 20 °C

3.1: N,N-dimethyl-formamide / 20 °C

4.1: sodium carbonate / tetrakis(triphenylphosphine) palladium⁽⁰⁾ / 1,4-dioxane; water / 100 °C / Inert atmosphere

5.1: triethylamine; 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride; benzotriazol-1-ol / N,N-dimethyl-formamide / 30 °C

5.2: 2 h / 30 °C

With dimethylsulfide borane complex; sodium carbonate; benzotriazol-1-ol; 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride; triethylamine; tetrakis(triphenylphosphine) palladium⁽⁰⁾; In 1,4-dioxane; ethanol; water; N,N-dimethyl-formamide;