6-[3-[4-[(4-Chlorophenyl)methyl]-1-piperazinyl]propoxy]-2-[(4-methoxyphenyl)methyl][1]benzopyrano[2,3-d]-1,2,3-triazol-9(2H)-one

Base Information

Chemical Name:6-[3-[4-[(4-Chlorophenyl)methyl]-1-piperazinyl]propoxy]-2-[(4-methoxyphenyl)methyl][1]benzopyrano[2,3-d]-1,2,3-triazol-9(2H)-one
CAS No.:79851-07-3
Molecular Formula:C₃₁H₃₂ClN₅O₄
Molecular Weight:574.079
Hs Code.:
DSSTox Substance ID:DTXSID901102935

Synonyms:DTXSID901102935;6-[3-[4-[(4-Chlorophenyl)methyl]-1-piperazinyl]propoxy]-2-[(4-methoxyphenyl)methyl][1]benzopyrano[2,3-d]-1,2,3-triazol-9(2H)-one;79851-07-3

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Chemical Property of 6-[3-[4-[(4-Chlorophenyl)methyl]-1-piperazinyl]propoxy]-2-[(4-methoxyphenyl)methyl][1]benzopyrano[2,3-d]-1,2,3-triazol-9(2H)-one

Chemical Property:

XLogP3:5.8
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:10
Exact Mass:573.2142822
Heavy Atom Count:41
Complexity:831

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:COC1=CC=C(C=C1)CN2N=C3C(=O)C4=C(C=C(C=C4)OCCCN5CCN(CC5)CC6=CC=C(C=C6)Cl)OC3=N2

Technology Process of 6-[3-[4-[(4-Chlorophenyl)methyl]-1-piperazinyl]propoxy]-2-[(4-methoxyphenyl)methyl][1]benzopyrano[2,3-d]-1,2,3-triazol-9(2H)-one

There total 2 articles about 6-[3-[4-[(4-Chlorophenyl)methyl]-1-piperazinyl]propoxy]-2-[(4-methoxyphenyl)methyl][1]benzopyrano[2,3-d]-1,2,3-triazol-9(2H)-one 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:

: 23145-88-2
1-[(4-chlorophenyl)methyl]piperazine

: 79851-07-3
6-{3-[4-(4-Chloro-benzyl)-piperazin-1-yl]-propoxy}-2-(4-methoxy-benzyl)-2H-4-oxa-1,2,3-triaza-cyclopenta[b]naphthalen-9-one

Guidance literature:: Multi-step reaction with 2 steps

1: K₂CO₃ / butan-2-one / Heating

2: 1.) K₂CO₃, 2.) diethyl azodicarboxylate, Ph₃P / 1.) DMF, RT, 24 h, 2.) THF, RT, 1.5 h

With potassium carbonate; triphenylphosphine; diethylazodicarboxylate; In butanone;
DOI:10.1021/jm00161a022

Reference yield:

: 824-94-2
p-methoxybenzyl chloride

: 79572-30-8
6-hydroxy<1>benzopyrano<2,3-d>-1,2,3-triazol-9(1H)-one

: 79837-34-6
3-[4-(4-Chloro-benzyl)-piperazin-1-yl]-propan-1-ol

: 79837-60-8
6-{3-[4-(4-Chloro-benzyl)-piperazin-1-yl]-propoxy}-1-(4-methoxy-benzyl)-1H-4-oxa-1,2,3-triaza-cyclopenta[b]naphthalen-9-one

: 79851-07-3
6-{3-[4-(4-Chloro-benzyl)-piperazin-1-yl]-propoxy}-2-(4-methoxy-benzyl)-2H-4-oxa-1,2,3-triaza-cyclopenta[b]naphthalen-9-one

Guidance literature:: With potassium carbonate; triphenylphosphine; diethylazodicarboxylate; Multistep reaction; 1.) DMF, RT, 24 h, 2.) THF, RT, 1.5 h;
DOI:10.1021/jm00161a022