3-methyl-4-(1-methyl-7-oxo-3-(pyridin-2-yl)-1,4,5,6,7,8-hexahydrocyclohepta[c]pyrazol-4-yl)benzoic acid

Base Information

Chemical Name:3-methyl-4-(1-methyl-7-oxo-3-(pyridin-2-yl)-1,4,5,6,7,8-hexahydrocyclohepta[c]pyrazol-4-yl)benzoic acid
CAS No.:1616364-26-1
Molecular Formula:C₂₂H₂₁N₃O₃
Molecular Weight:375.427
Hs Code.:

Synonyms:3-methyl-4-(1-methyl-7-oxo-3-(pyridin-2-yl)-1,4,5,6,7,8-hexahydrocyclohepta[c]pyrazol-4-yl)benzoic acid

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Chemical Property of 3-methyl-4-(1-methyl-7-oxo-3-(pyridin-2-yl)-1,4,5,6,7,8-hexahydrocyclohepta[c]pyrazol-4-yl)benzoic acid

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Technology Process of 3-methyl-4-(1-methyl-7-oxo-3-(pyridin-2-yl)-1,4,5,6,7,8-hexahydrocyclohepta[c]pyrazol-4-yl)benzoic acid

There total 3 articles about 3-methyl-4-(1-methyl-7-oxo-3-(pyridin-2-yl)-1,4,5,6,7,8-hexahydrocyclohepta[c]pyrazol-4-yl)benzoic acid 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: 58.0%

: 1616364-25-0
methyl 4-(1-(5-(2-ethoxy-2-oxoethyl)-1-methyl-3-(pyridin-2-yl)-1H-pyrazol-4-yl)-4-methoxy-4-oxobutyl)-3-methylbenzoate

: 1616364-26-1
3-methyl-4-(1-methyl-7-oxo-3-(pyridin-2-yl)-1,4,5,6,7,8-hexahydrocyclohepta[c]pyrazol-4-yl)benzoic acid

Guidance literature:: methyl 4-(1-(5-(2-ethoxy-2-oxoethyl)-1-methyl-3-(pyridin-2-yl)-1H-pyrazol-4-yl)-4-methoxy-4-oxobutyl)-3-methylbenzoate; In toluene; for 16h; Molecular sieve; Reflux;

With lithium hexamethyldisilazane; In toluene; at 0 - 20 ℃; for 22h;

Reference yield:

: 1616364-23-8
4-(3-carboxy-1-(5-chloro-1-methyl-3-(pyridin-2-yl)-1H-pyrazol-4-yl)propyl)-3-methylbenzoic acid

: 1616364-26-1
3-methyl-4-(1-methyl-7-oxo-3-(pyridin-2-yl)-1,4,5,6,7,8-hexahydrocyclohepta[c]pyrazol-4-yl)benzoic acid

Guidance literature:: Multi-step reaction with 3 steps

1.1: potassium carbonate / N,N-dimethyl-formamide / 4 h / 20 °C

2.1: XPhos; dmap; bis(η3-allyl-μ-chloropalladium(II)) / 1,3,5-trimethyl-benzene / 16 h / 120 °C / Inert atmosphere

3.1: toluene / 16 h / Molecular sieve; Reflux

3.2: 22 h / 0 - 20 °C

With dmap; bis(η3-allyl-μ-chloropalladium(II)); potassium carbonate; XPhos; In N,N-dimethyl-formamide; toluene; 1,3,5-trimethyl-benzene;

Reference yield:

: 1616364-24-9
methyl 4-(1-(5-chloro-1-methyl-3-(pyridin-2-yl)-1H-pyrazol-4-yl)-4-methoxy-4-oxobutyl)-3-methylbenzoate

: 1616364-26-1
3-methyl-4-(1-methyl-7-oxo-3-(pyridin-2-yl)-1,4,5,6,7,8-hexahydrocyclohepta[c]pyrazol-4-yl)benzoic acid

Guidance literature:: Multi-step reaction with 2 steps

1.1: XPhos; dmap; bis(η3-allyl-μ-chloropalladium(II)) / 1,3,5-trimethyl-benzene / 16 h / 120 °C / Inert atmosphere

2.1: toluene / 16 h / Molecular sieve; Reflux

2.2: 22 h / 0 - 20 °C

With dmap; bis(η3-allyl-μ-chloropalladium(II)); XPhos; In toluene; 1,3,5-trimethyl-benzene;