1H-Purine-2,6-dione, 8-(4-aminophenyl)-3,7-dihydro-1,3-dipropyl-

Base Information

Chemical Name:1H-Purine-2,6-dione, 8-(4-aminophenyl)-3,7-dihydro-1,3-dipropyl-
CAS No.:102587-80-4
Molecular Formula:C17H21N5O2
Molecular Weight:327.386
Hs Code.:
DSSTox Substance ID:DTXSID90458516
Wikidata:Q82281865
Pharos Ligand ID:YC19CAAFPPKL
ChEMBL ID:CHEMBL32598
Mol file:102587-80-4.mol

Synonyms:CHEMBL32598;102587-80-4;1H-Purine-2,6-dione, 8-(4-aminophenyl)-3,7-dihydro-1,3-dipropyl-;SCHEMBL7318202;DTXSID90458516;BDBM50021450;8-(4-Amino-phenyl)-1,3-dipropyl-3,7-dihydro-purine-2,6-dione

Suppliers and Price of 1H-Purine-2,6-dione, 8-(4-aminophenyl)-3,7-dihydro-1,3-dipropyl-

Supply Marketing:

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

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Chemical Property of 1H-Purine-2,6-dione, 8-(4-aminophenyl)-3,7-dihydro-1,3-dipropyl-

Chemical Property:

XLogP3:3.6
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:5
Exact Mass:327.16952493
Heavy Atom Count:24
Complexity:478

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:CCCN1C2=C(C(=O)N(C1=O)CCC)NC(=N2)C3=CC=C(C=C3)N

Technology Process of 1H-Purine-2,6-dione, 8-(4-aminophenyl)-3,7-dihydro-1,3-dipropyl-

There total 4 articles about 1H-Purine-2,6-dione, 8-(4-aminophenyl)-3,7-dihydro-1,3-dipropyl- 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:

: 81250-34-2
1,3-dipropyl-5,6-diaminouracil

: 102587-80-4
1,3-dipropyl-8-(4-aminophenyl)xanthine

Guidance literature:: Multi-step reaction with 2 steps

1: EDAC / methanol / 5 h / 20 °C

2: aq. NaOH / methanol / 12 h / 70 - 80 °C

With sodium hydroxide; 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride; In methanol;
DOI:10.1021/jm0309654

Reference yield:

: 81250-33-1
1,3-di-n-propyl-5-nitroso-6-aminouracil

: 102587-80-4
1,3-dipropyl-8-(4-aminophenyl)xanthine

Guidance literature:: Multi-step reaction with 3 steps

1: Na₂S₂O₄; aq. NH₃

2: EDAC / methanol / 5 h / 20 °C

3: aq. NaOH / methanol / 12 h / 70 - 80 °C

With ammonium hydroxide; sodium hydroxide; sodium dithionite; 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride; In methanol;
DOI:10.1021/jm0309654

Reference yield:

: 150-13-0,159246-81-8,8014-65-1
4-amino-benzoic acid

: 102587-80-4
1,3-dipropyl-8-(4-aminophenyl)xanthine

Guidance literature:: Multi-step reaction with 2 steps

1: 97 percent / ethyl acetate / 4.5 h

2: 1.) diisopropylcarbodiimide, 2.) 10percent aq. NaOH / 1.) MeOH, overnight, 2.) DMF, reflux, 15 min

With sodium hydroxide; diisopropyl-carbodiimide; In ethyl acetate;
DOI:10.1021/jm00158a034