N-[4-[N-methyl-N-(tetrahydropyran-4-yl)aminomethyl]phenyl]-7-(4-trifluoromethylphenyl)-2,3-dihydro-1-benzoxepine-4-carboxamide

Base Information

Chemical Name:N-[4-[N-methyl-N-(tetrahydropyran-4-yl)aminomethyl]phenyl]-7-(4-trifluoromethylphenyl)-2,3-dihydro-1-benzoxepine-4-carboxamide
CAS No.:229005-16-7
Molecular Formula:C₃₁H₃₁F₃N₂O₃
Molecular Weight:536.594
Hs Code.:

Synonyms:N-[4-[N-methyl-N-(tetrahydropyran-4-yl)aminomethyl]phenyl]-7-(4-trifluoromethylphenyl)-2,3-dihydro-1-benzoxepine-4-carboxamide

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Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

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Chemical Property of N-[4-[N-methyl-N-(tetrahydropyran-4-yl)aminomethyl]phenyl]-7-(4-trifluoromethylphenyl)-2,3-dihydro-1-benzoxepine-4-carboxamide

Chemical Property:

Purity/Quality:: 98% ^*data from raw suppliers

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Technology Process of N-[4-[N-methyl-N-(tetrahydropyran-4-yl)aminomethyl]phenyl]-7-(4-trifluoromethylphenyl)-2,3-dihydro-1-benzoxepine-4-carboxamide

There total 13 articles about N-[4-[N-methyl-N-(tetrahydropyran-4-yl)aminomethyl]phenyl]-7-(4-trifluoromethylphenyl)-2,3-dihydro-1-benzoxepine-4-carboxamide 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: 43.0%

: 229007-09-4
4-[N-methyl-N-(tetrahydro-2H-pyran-4-yl)aminomethyl]aniline

: 7-(4-trifluoromethyl-phenyl)-2,3-dihydro-benzo[b]oxepine-4-carbonyl chloride

: 229005-16-7
N-[4-[N-methyl-N-(tetrahydropyran-4-yl)aminomethyl]phenyl]-7-(4-trifluoromethylphenyl)-2,3-dihydro-1-benzoxepine-4-carboxamide

Guidance literature:: With triethylamine; In tetrahydrofuran; at 20 ℃;
DOI:10.1021/jm9906264

Reference yield:

: 79-37-8
oxalyl dichloride

: 229007-09-4
4-[N-methyl-N-(tetrahydro-2H-pyran-4-yl)aminomethyl]aniline

: 229007-84-5
7-(4-trifluoromethylphenyl)-2,3-dihydro-1-benzoxepine-4-carboxylic acid

: 229005-16-7
N-[4-[N-methyl-N-(tetrahydropyran-4-yl)aminomethyl]phenyl]-7-(4-trifluoromethylphenyl)-2,3-dihydro-1-benzoxepine-4-carboxamide

Guidance literature:: With triethylamine; In tetrahydrofuran; water; N,N-dimethyl-formamide;

Reference yield:

: 29943-42-8,143562-54-3
Tetrahydro-4H-pyran-4-one

: 229005-16-7
N-[4-[N-methyl-N-(tetrahydropyran-4-yl)aminomethyl]phenyl]-7-(4-trifluoromethylphenyl)-2,3-dihydro-1-benzoxepine-4-carboxamide

Guidance literature:: Multi-step reaction with 4 steps

1: Et₃N; NaBH(OAc)3 / 1,2-dichloro-ethane / 8 h / 20 °C

2: 100 percent / aq. NaBH(OAc)3 / 1,2-dichloro-ethane / 20 °C

3: 79 percent / Fe; AcOH / 20 °C

4: 43 percent / Et₃N / tetrahydrofuran / 20 °C

With sodium tris(acetoxy)borohydride; iron; acetic acid; triethylamine; In tetrahydrofuran; 1,2-dichloro-ethane; 1: reductive amination / 2: reductive amination / 3: Reduction / 4: Acylation;
DOI:10.1021/jm9906264