1-(4-{5-[(4,5-dimethyl-6-oxo-1,6-dihydropyridazin-3-yl)methyl]-2-fluorobenzoyl}piperazin-1-yl)-N,2-dimethyl-1-oxo-propan-2-aminium trifluoroacetate

Base Information

Chemical Name:1-(4-{5-[(4,5-dimethyl-6-oxo-1,6-dihydropyridazin-3-yl)methyl]-2-fluorobenzoyl}piperazin-1-yl)-N,2-dimethyl-1-oxo-propan-2-aminium trifluoroacetate
CAS No.:959839-45-3
Molecular Formula:C₂HF₃O₂*C₂₃H₃₀FN₅O₃
Molecular Weight:557.545
Hs Code.:

1-(4-{5-[(4,5-dimethyl-6-oxo-1,6-dihydropyridazin-3-yl)methyl]-2-fluorobenzoyl}piperazin-1-yl)-N,2-dimethyl-1-oxo-propan-2-aminium trifluoroacetate

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Chemical Property of 1-(4-{5-[(4,5-dimethyl-6-oxo-1,6-dihydropyridazin-3-yl)methyl]-2-fluorobenzoyl}piperazin-1-yl)-N,2-dimethyl-1-oxo-propan-2-aminium trifluoroacetate

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Technology Process of 1-(4-{5-[(4,5-dimethyl-6-oxo-1,6-dihydropyridazin-3-yl)methyl]-2-fluorobenzoyl}piperazin-1-yl)-N,2-dimethyl-1-oxo-propan-2-aminium trifluoroacetate

There total 3 articles about 1-(4-{5-[(4,5-dimethyl-6-oxo-1,6-dihydropyridazin-3-yl)methyl]-2-fluorobenzoyl}piperazin-1-yl)-N,2-dimethyl-1-oxo-propan-2-aminium trifluoroacetate 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:

: 959841-63-5
5-[(4,5-dimethyl-6-oxo-1,6-dihydro-pyridazin-3-yl)methyl]-2-fluorobenzonitrile

: 959839-45-3
1-(4-{5-[(4,5-dimethyl-6-oxo-1,6-dihydropyridazin-3-yl)methyl]-2-fluorobenzoyl}piperazin-1-yl)-N,2-dimethyl-1-oxo-propan-2-aminium trifluoroacetate

Guidance literature:: Multi-step reaction with 5 steps

1.1: sodium hydroxide; water / 1 h / 100 °C

1.2: 0 °C / pH 2 - 3

2.1: O-(1H-benzotriazol-1-yl)-N,N,N',N'-tetramethyluronium hexafluorophosphate; N-ethyl-N,N-diisopropylamine / N,N-dimethyl-formamide / 0.17 h / 20 °C

2.2: 20 °C

3.1: dichloromethane / 1 h / 20 °C

4.1: N-ethyl-N,N-diisopropylamine; HATU / N,N-dimethyl-formamide / 0.17 h / 20 °C

4.2: 20 °C

5.1: water; acetonitrile

With sodium hydroxide; water; O-(1H-benzotriazol-1-yl)-N,N,N',N'-tetramethyluronium hexafluorophosphate; N-ethyl-N,N-diisopropylamine; HATU; In dichloromethane; water; N,N-dimethyl-formamide; acetonitrile;

Reference yield:

: 959841-61-3
5-[(6-chloro-4,5-dimethylpyridazin-3-yl)(cyano)methyl]-2-fluorobenzonitrile

: 959839-45-3
1-(4-{5-[(4,5-dimethyl-6-oxo-1,6-dihydropyridazin-3-yl)methyl]-2-fluorobenzoyl}piperazin-1-yl)-N,2-dimethyl-1-oxo-propan-2-aminium trifluoroacetate

Guidance literature:: Multi-step reaction with 7 steps

1.1: hydrogenchloride; water; acetic acid / 1.25 h / Heating / reflux

1.2: 20 °C

2.1: sodium acetate; acetic acid / 1 h / Heating / reflux

3.1: sodium hydroxide; water / 1 h / 100 °C

3.2: 0 °C / pH 2 - 3

4.1: O-(1H-benzotriazol-1-yl)-N,N,N',N'-tetramethyluronium hexafluorophosphate; N-ethyl-N,N-diisopropylamine / N,N-dimethyl-formamide / 0.17 h / 20 °C

4.2: 20 °C

5.1: dichloromethane / 1 h / 20 °C

6.1: N-ethyl-N,N-diisopropylamine; HATU / N,N-dimethyl-formamide / 0.17 h / 20 °C

6.2: 20 °C

7.1: water; acetonitrile

With hydrogenchloride; sodium hydroxide; water; sodium acetate; O-(1H-benzotriazol-1-yl)-N,N,N',N'-tetramethyluronium hexafluorophosphate; acetic acid; N-ethyl-N,N-diisopropylamine; HATU; In dichloromethane; water; N,N-dimethyl-formamide; acetonitrile;