4-(1,3-Diethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)-N-(2-dimethylamino-ethyl)-benzenesulfonamide

Base Information

Chemical Name:4-(1,3-Diethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)-N-(2-dimethylamino-ethyl)-benzenesulfonamide
CAS No.:89073-49-4
Molecular Formula:C19H26N6O4S
Molecular Weight:434.519
Hs Code.:
ChEMBL ID:CHEMBL276201
DSSTox Substance ID:DTXSID10878439
Nikkaji Number:J1.597.884H
Wikidata:Q82860473

Synonyms:CHEMBL276201;89073-49-4;SCHEMBL10803925;DTXSID10878439;KXXRKZIKDIWNSN-UHFFFAOYSA-N;BDBM50020987;BENZENESULFONAMIDE, 4-(1,3-DIETHYL-2,3,6,7-TETRA;4-(1,3-diethyl-2,3,6,7-tetrahydro-2,6-dioxo-1H-purin-8-yl)-N-[2-(dimethylamino)ethyl]benzene-sulfonamide;4-(1,3-Diethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)-N-(2-dimethylamino-ethyl)-benzenesulfonamide

Suppliers and Price of 4-(1,3-Diethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)-N-(2-dimethylamino-ethyl)-benzenesulfonamide

Supply Marketing:

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

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Chemical Property of 4-(1,3-Diethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)-N-(2-dimethylamino-ethyl)-benzenesulfonamide

Chemical Property:

XLogP3:2.6
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:8
Exact Mass:434.17362451
Heavy Atom Count:30
Complexity:732

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CCN1C2=C(C(=O)N(C1=O)CC)NC(=N2)C3=CC=C(C=C3)S(=O)(=O)NCCN(C)C

Technology Process of 4-(1,3-Diethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)-N-(2-dimethylamino-ethyl)-benzenesulfonamide

There total 6 articles about 4-(1,3-Diethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)-N-(2-dimethylamino-ethyl)-benzenesulfonamide 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:

: 108-00-9
N,N-dimethylethylenediamine

: 89073-47-2
4-(1,3-diethyl-2,3,6,7-tetrahydro-2,6-dioxo-1H-purin-8-yl)benzenesulfonic acid

: 89073-49-4
4-(1,3-Diethyl-2,3,6,7-tetrahydro-2,6-dioxo-1H-purin-8-yl)-N-[2-(dimethylamino)ethyl]benzenesulfonamide

Guidance literature:: With thionyl chloride; In water; N,N-dimethyl-formamide;

Reference yield:

: 52998-22-8
5,6-diamino-1,3-diethyluracil

: 89073-49-4
4-(1,3-Diethyl-2,3,6,7-tetrahydro-2,6-dioxo-1H-purin-8-yl)-N-[2-(dimethylamino)ethyl]benzenesulfonamide

Guidance literature:: Multi-step reaction with 4 steps

1: ethyl <3-(dimethylamino)propyl>carbodiimide (EDAC) / H₂O

2: 30percent aq. KOH / 0.17 h / Heating

3: SOCl₂ / dimethylformamide / 0 - 20 °C

4: dimethylformamide / Ambient temperature

With potassium hydroxide; thionyl chloride; N-(3-dimethylaminopropyl)-N-ethylcarbodiimide; In water; N,N-dimethyl-formamide;
DOI:10.1021/jm00146a016

Reference yield:

: 636-78-2,97993-77-6
4-sulphobenzoic acid

: 89073-49-4
4-(1,3-Diethyl-2,3,6,7-tetrahydro-2,6-dioxo-1H-purin-8-yl)-N-[2-(dimethylamino)ethyl]benzenesulfonamide

Guidance literature:: Multi-step reaction with 4 steps

1: ethyl <3-(dimethylamino)propyl>carbodiimide (EDAC) / H₂O

2: 30percent aq. KOH / 0.17 h / Heating

3: SOCl₂ / dimethylformamide / 0 - 20 °C

4: dimethylformamide / Ambient temperature

With potassium hydroxide; thionyl chloride; N-(3-dimethylaminopropyl)-N-ethylcarbodiimide; In water; N,N-dimethyl-formamide;
DOI:10.1021/jm00146a016