(E)-1,3-Diethyl-8-(4-methoxy-2,3-dimethylstyryl)-7-methylxanthine

Base Information

Chemical Name:(E)-1,3-Diethyl-8-(4-methoxy-2,3-dimethylstyryl)-7-methylxanthine
CAS No.:155271-07-1
Molecular Formula:C₂₁H₂₆N₄O₃
Molecular Weight:382.462
Hs Code.:
Wikidata:Q76389361
ChEMBL ID:CHEMBL77698
Mol file:155271-07-1.mol

Synonyms:(E)-1,3-Diethyl-8-(4-methoxy-2,3-dimethylstyryl)-7-methylxanthine;155271-07-1;CHEMBL77698;1H-Purine-2,6-dione, 3,7-dihydro-1,3-diethyl-8-(2-(2,3-dimethyl-4-methoxy)phenyl)ethenyl)-7-methyl-, (E)-;SCHEMBL7306951;SCHEMBL7306965;BDBM50290167;LS-126713;L010560;1,3-Diethyl-8-[(E)-2-(4-methoxy-2,3-dimethyl-phenyl)-vinyl]-7-methyl-3,7-dihydro-purine-2,6-dione

Suppliers and Price of (E)-1,3-Diethyl-8-(4-methoxy-2,3-dimethylstyryl)-7-methylxanthine

Supply Marketing:

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

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Chemical Property of (E)-1,3-Diethyl-8-(4-methoxy-2,3-dimethylstyryl)-7-methylxanthine

Chemical Property:

Vapor Pressure:2.88E-14mmHg at 25°C
Boiling Point:598.1°Cat760mmHg
Flash Point:315.5°C
Density:1.2g/cm³
XLogP3:3.3
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:5
Exact Mass:382.20049070
Heavy Atom Count:28
Complexity:625

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:CCN1C2=C(C(=O)N(C1=O)CC)N(C(=N2)C=CC3=C(C(=C(C=C3)OC)C)C)C
Isomeric SMILES:CCN1C2=C(C(=O)N(C1=O)CC)N(C(=N2)/C=C/C3=C(C(=C(C=C3)OC)C)C)C

Technology Process of (E)-1,3-Diethyl-8-(4-methoxy-2,3-dimethylstyryl)-7-methylxanthine

There total 4 articles about (E)-1,3-Diethyl-8-(4-methoxy-2,3-dimethylstyryl)-7-methylxanthine 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: 95.0%

: 155271-07-1
(E)-1,3-Diethyl-8-(4-methoxy-2,3-dimethylstyryl)-7-methylxanthine

Guidance literature:

Reference yield:

: 155271-06-0
(E)-1,3-Diethyl-8-(4-methoxy-2,3-dimethylstyryl)xanthine

: 74-88-4
methyl iodide

: 155271-07-1
(E)-1,3-Diethyl-8-(4-methoxy-2,3-dimethylstyryl)-7-methylxanthine

Guidance literature:: With potassium carbonate; In N,N-dimethyl-formamide; at 50 ℃;
DOI:10.1016/S0960-894X(97)00440-X

Reference yield:

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

: 155271-07-1
(E)-1,3-Diethyl-8-(4-methoxy-2,3-dimethylstyryl)-7-methylxanthine

Guidance literature:: Multi-step reaction with 2 steps

1: 1) 1-<3-(dimethylamino)propyl>-3-ethylcarbodiimide hydrochloride, 2) 1N NaOH / 1) dioxane, H₂O, 2) dioxane, H₂O, reflux

2: K₂CO₃ / dimethylformamide / 50 °C

With sodium hydroxide; potassium carbonate; 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride; In N,N-dimethyl-formamide;
DOI:10.1016/S0960-894X(97)00440-X