4H-(1,2,4)Triazolo(4,3-a)(1,5)benzodiazepine, 5-(4-methyl-1-piperazinyl)-

Base Information

Chemical Name:4H-(1,2,4)Triazolo(4,3-a)(1,5)benzodiazepine, 5-(4-methyl-1-piperazinyl)-
CAS No.:137731-14-7
Molecular Formula:C₁₅H₁₈N₆
Molecular Weight:282.348
Hs Code.:
DSSTox Substance ID:DTXSID50160284
Nikkaji Number:J425.856H
Mol file:137731-14-7.mol

Synonyms:BRN 4815643;4H-(1,2,4)Triazolo(4,3-a)(1,5)benzodiazepine, 5-(4-methyl-1-piperazinyl)-;5-(4-Methyl-1-piperazinyl)-4H-(1,2,4)triazolo(4,3-a)(1,5)benzodiazepine;137731-14-7;DTXSID50160284;LS-156366;5-(4-Methylpiperazino)-4H-[1,2,4]triazolo[4,3-a][1,5]benzodiazepine

Suppliers and Price of 4H-(1,2,4)Triazolo(4,3-a)(1,5)benzodiazepine, 5-(4-methyl-1-piperazinyl)-

Supply Marketing:

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

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Chemical Property of 4H-(1,2,4)Triazolo(4,3-a)(1,5)benzodiazepine, 5-(4-methyl-1-piperazinyl)-

Chemical Property:

Vapor Pressure:4.77E-10mmHg at 25°C
Boiling Point:497.8°C at 760 mmHg
Flash Point:254.9°C
Density:1.37g/cm³
XLogP3:0
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:1
Exact Mass:282.15929460
Heavy Atom Count:21
Complexity:403

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CN1CCN(CC1)C2=NC3=CC=CC=C3N4C=NN=C4C2

Technology Process of 4H-(1,2,4)Triazolo(4,3-a)(1,5)benzodiazepine, 5-(4-methyl-1-piperazinyl)-

There total 2 articles about 4H-(1,2,4)Triazolo(4,3-a)(1,5)benzodiazepine, 5-(4-methyl-1-piperazinyl)- 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:

: 62537-60-4
2-(Dimethylamino)-1,3-dihydro-2H-1,5-benzodiazepin-2-one

: 137731-14-7
5-(4-Methyl-piperazin-1-yl)-4H-2,3,6,10b-tetraaza-benzo[e]azulene

Guidance literature:: Multi-step reaction with 2 steps

1: 54 percent / glacial CH₃COOH / various solvent(s) / 2 h / 200 °C

2: 1.) titanium tetrachloride, anisole / 1.) toluene, 0 deg C, 2.) toluene, 6h

With titanium tetrachloride; acetic acid; methoxybenzene; In various solvent(s);
DOI:10.1016/0223-5234(91)90144-C

Reference yield:

: 109-01-3
1-methyl-piperazine

: 137731-06-7
4H-<1,2,4>-triazolo<4,3-a><1,5>benzodiazepin-5(6H)-one

: 137731-14-7
5-(4-Methyl-piperazin-1-yl)-4H-2,3,6,10b-tetraaza-benzo[e]azulene

Guidance literature:: With titanium tetrachloride; methoxybenzene; Yield given. Multistep reaction; 1.) toluene, 0 deg C, 2.) toluene, 6h;
DOI:10.1016/0223-5234(91)90144-C