5H-1,2,4-Triazolo(3,4-i)purin-5-one, 6,9-dihydro-9-methyl-6-propyl-3-(4-pyridinyl)-

Base Information

Chemical Name:5H-1,2,4-Triazolo(3,4-i)purin-5-one, 6,9-dihydro-9-methyl-6-propyl-3-(4-pyridinyl)-
CAS No.:135445-74-8
Molecular Formula:C15H15N7O
Molecular Weight:309.3259
Hs Code.:
DSSTox Substance ID:DTXSID30159353
Wikidata:Q83027662
Mol file:135445-74-8.mol

Synonyms:5H-1,2,4-Triazolo(3,4-i)purin-5-one, 6,9-dihydro-9-methyl-6-propyl-3-(4-pyridinyl)-;135445-74-8;9-Methyl-6-propyl-3-(4-pyridinyl)-6,9-dihydro-5H-1,2,4-triazolo(3,4-i)purin-5-one;6,9-Dihydro-9-methyl-6-n-propyl-3-(4-pyridyl)-5H-1,2,4-triazolo(3,4-i)purin-5-one;SCHEMBL9031357;DTXSID30159353;LS-156663

Suppliers and Price of 5H-1,2,4-Triazolo(3,4-i)purin-5-one, 6,9-dihydro-9-methyl-6-propyl-3-(4-pyridinyl)-

Supply Marketing:

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

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
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price

Total 1 raw suppliers

Chemical Property of 5H-1,2,4-Triazolo(3,4-i)purin-5-one, 6,9-dihydro-9-methyl-6-propyl-3-(4-pyridinyl)-

Chemical Property:

Vapor Pressure:1.15E-18mmHg at 25°C
Boiling Point:685.9°Cat760mmHg
Flash Point:368.6°C
Density:1.49g/cm³
XLogP3:0.6
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:3
Exact Mass:309.13380813
Heavy Atom Count:23
Complexity:455

Purity/Quality:: 85.0-99.8% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CCCN1C2=C(C3=NN=C(N3C1=O)C4=CC=NC=C4)N(C=N2)C

Technology Process of 5H-1,2,4-Triazolo(3,4-i)purin-5-one, 6,9-dihydro-9-methyl-6-propyl-3-(4-pyridinyl)-

There total 4 articles about 5H-1,2,4-Triazolo(3,4-i)purin-5-one, 6,9-dihydro-9-methyl-6-propyl-3-(4-pyridinyl)- 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: 76.0%

: 142559-99-7
Isonicotinic acid N'-(7-methyl-2-oxo-3-propyl-3,7-dihydro-2H-purin-6-yl)-hydrazide

: 135445-74-8
6,9-dihydro-9-methyl-6-n-propyl-3-(pyridin-4-yl)-5H-1,2,4-triazolo[3,4-i]purin-5-one

Guidance literature:: With toluene-4-sulfonic acid; In toluene; for 2h; Heating;
DOI:10.1016/S0040-4039(00)79837-6

Reference yield:

: 54-85-3,7640-37-1
isoniazid

: 135445-74-8
6,9-dihydro-9-methyl-6-n-propyl-3-(pyridin-4-yl)-5H-1,2,4-triazolo[3,4-i]purin-5-one

Guidance literature:: Multi-step reaction with 2 steps

1: 54 percent / dimethylsulfoxide / 0.5 h / 150 °C

2: 76 percent / p-toluenesulfonic acid / toluene; various solvent(s) / 2 h / Heating; other 3,7-dialkyl-6-(N'-isonicotinoylhydrazino)-7H-purin-2(3H)-ones

With toluene-4-sulfonic acid; In dimethyl sulfoxide; toluene;
DOI:10.1016/S0040-4039(00)79837-6

Reference yield:

: 135445-56-6
7-methyl-6-methylthio-3-propyl-7H-purin-2(3H)-one

: 135445-74-8
6,9-dihydro-9-methyl-6-n-propyl-3-(pyridin-4-yl)-5H-1,2,4-triazolo[3,4-i]purin-5-one

Guidance literature:: Multi-step reaction with 2 steps

1: 54 percent / dimethylsulfoxide / 0.5 h / 150 °C

2: 76 percent / p-toluenesulfonic acid / toluene; various solvent(s) / 2 h / Heating; other 3,7-dialkyl-6-(N'-isonicotinoylhydrazino)-7H-purin-2(3H)-ones

With toluene-4-sulfonic acid; In dimethyl sulfoxide; toluene;
DOI:10.1016/S0040-4039(00)79837-6