8-Methoxy-1-(2'-methoxybiphenyl-4-yl)-5,6-dihydro-4H-pyrido[2,3-f][1,2,4]triazolo[4,3-a][1,4]diazepine

Base Information

Chemical Name:8-Methoxy-1-(2'-methoxybiphenyl-4-yl)-5,6-dihydro-4H-pyrido[2,3-f][1,2,4]triazolo[4,3-a][1,4]diazepine
CAS No.:871583-45-8
Molecular Formula:C₂₃H₂₁N₅O₂
Molecular Weight:399.452
Hs Code.:
DSSTox Substance ID:DTXSID601108677
Nikkaji Number:J2.949.433I

Synonyms:SCHEMBL5620811;SUFHFTNIGGSKEO-UHFFFAOYSA-N;DTXSID601108677;8-Methoxy-1-(2'-methoxybiphenyl-4-yl)-5,6-dihydro-4H-pyrido[2,3-f][1,2,4]triazolo[4,3-a][1,4]diazepine;871583-45-8;5,6-Dihydro-8-methoxy-1-(2'-methoxy[1,1'-biphenyl]-4-yl)-4H-pyrido[2,3-f][1,2,4]triazolo[4,3-a][1,4]diazepine

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Chemical Property of 8-Methoxy-1-(2'-methoxybiphenyl-4-yl)-5,6-dihydro-4H-pyrido[2,3-f][1,2,4]triazolo[4,3-a][1,4]diazepine

Chemical Property:

XLogP3:2.6
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:4
Exact Mass:399.16952493
Heavy Atom Count:30
Complexity:558

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:COC1=NC2=C(C=C1)N3C(=NN=C3C4=CC=C(C=C4)C5=CC=CC=C5OC)CNC2

Technology Process of 8-Methoxy-1-(2'-methoxybiphenyl-4-yl)-5,6-dihydro-4H-pyrido[2,3-f][1,2,4]triazolo[4,3-a][1,4]diazepine

There total 3 articles about 8-Methoxy-1-(2'-methoxybiphenyl-4-yl)-5,6-dihydro-4H-pyrido[2,3-f][1,2,4]triazolo[4,3-a][1,4]diazepine 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%

: C₃₀H₂₇N₅O₂

: 871583-45-8
8-methoxy-1-(2'-methoxybiphenyl-4-yl)-5,6-dihydro-4H-pyrido[2,3-f][1,2,4]triazolo[4,3-a][1,4]diazepine

Guidance literature:: With 20 % Pd(OH)2/C; ammonium formate; In ethanol; for 8h; Reflux; Inert atmosphere;
DOI:10.1080/00397911003707170

Reference yield:

: 5720-06-9
2-Methoxyphenylboronic acid

: 871583-45-8
8-methoxy-1-(2'-methoxybiphenyl-4-yl)-5,6-dihydro-4H-pyrido[2,3-f][1,2,4]triazolo[4,3-a][1,4]diazepine

Guidance literature:: Multi-step reaction with 2 steps

1: tetrakis(triphenylphosphine) palladium⁽⁰⁾; sodium carbonate / 1,2-dimethoxyethane; water / 5 h / 120 °C

2: 20 % Pd(OH)2/C; ammonium formate / ethanol / 8 h / Reflux; Inert atmosphere

With tetrakis(triphenylphosphine) palladium⁽⁰⁾; 20 % Pd(OH)2/C; ammonium formate; sodium carbonate; In 1,2-dimethoxyethane; ethanol; water; 1: Suzuki coupling;
DOI:10.1080/00397911003707170

Reference yield:

: 871583-97-0
5-benzyl-1-(4-bromophenyl)-8-methoxy-5,6-dihydro-4H-pyrido[2,3-f][1,2,4]triazolo[4,3-a][1,4]diazepine

: 871583-45-8
8-methoxy-1-(2'-methoxybiphenyl-4-yl)-5,6-dihydro-4H-pyrido[2,3-f][1,2,4]triazolo[4,3-a][1,4]diazepine

Guidance literature:: Multi-step reaction with 2 steps

1: tetrakis(triphenylphosphine) palladium⁽⁰⁾; sodium carbonate / 1,2-dimethoxyethane; water / 5 h / 120 °C

2: 20 % Pd(OH)2/C; ammonium formate / ethanol / 8 h / Reflux; Inert atmosphere

With tetrakis(triphenylphosphine) palladium⁽⁰⁾; 20 % Pd(OH)2/C; ammonium formate; sodium carbonate; In 1,2-dimethoxyethane; ethanol; water; 1: Suzuki coupling;
DOI:10.1080/00397911003707170