6-Butyl-3-benzhydrylpyrimidine-2,4(1H,3H)-dione

Base Information

Chemical Name:6-Butyl-3-benzhydrylpyrimidine-2,4(1H,3H)-dione
CAS No.:821795-54-4
Molecular Formula:C21H22N2O2
Molecular Weight:334.418
Hs Code.:
DSSTox Substance ID:DTXSID50457762
Nikkaji Number:J2.134.907K
Wikidata:Q82280746

Synonyms:821795-54-4;6-Butyl-3-benzhydrylpyrimidine-2,4(1H,3H)-dione;CTK3E1553;DTXSID50457762

Suppliers and Price of 6-Butyl-3-benzhydrylpyrimidine-2,4(1H,3H)-dione

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
Packaging
price

Total 1 raw suppliers

Chemical Property of 6-Butyl-3-benzhydrylpyrimidine-2,4(1H,3H)-dione

Chemical Property:

XLogP3:4.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:6
Exact Mass:334.168127949
Heavy Atom Count:25
Complexity:484

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:CCCCC1=CC(=O)N(C(=O)N1)C(C2=CC=CC=C2)C3=CC=CC=C3

Technology Process of 6-Butyl-3-benzhydrylpyrimidine-2,4(1H,3H)-dione

There total 1 articles about 6-Butyl-3-benzhydrylpyrimidine-2,4(1H,3H)-dione 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: 55.0%

: 116137-73-6
6-(butyl)-1H-pyrimidin-4-one

: 776-74-9
Bromodiphenylmethane

: 821795-54-4
3-benzhydryl-6-butyl-1H-pyrimidine-2,4-dione

Guidance literature:: 6-(butyl)-1H-pyrimidin-4-one; With N,O-bis-(trimethylsilyl)-acetamide; In acetonitrile; at 20 ℃;

Bromodiphenylmethane; With iodine; In acetonitrile; Heating;
DOI:10.1021/jo0485076

Reference yield: 93.0%

: 821795-54-4
3-benzhydryl-6-butyl-1H-pyrimidine-2,4-dione

: 100-39-0
benzyl bromide

: 821795-62-4
3-benzhydryl-1-benzyl-6-butyl-1H-pyrimidine-2,4-dione

Guidance literature:: With potassium carbonate; In N,N-dimethyl-formamide; at 20 ℃;
DOI:10.1021/jo0485076

Reference yield:

: 821795-54-4
3-benzhydryl-6-butyl-1H-pyrimidine-2,4-dione

: 1-benzyl-6-butyl-1H-pyrimidine-2,4-dione

Guidance literature:: Multi-step reaction with 2 steps

1: 93 percent / potassium carbonate / dimethylformamide / 20 °C

2: 100 percent / triflic acid / trifluoroacetic acid / 0 °C

With trifluorormethanesulfonic acid; potassium carbonate; In N,N-dimethyl-formamide; trifluoroacetic acid;
DOI:10.1021/jo0485076