2,3-Piperazinedione, 1-(phenylmethyl)-4-((4-(2-pyrimidinylamino)phenyl)methyl)-

Base Information

Chemical Name:2,3-Piperazinedione, 1-(phenylmethyl)-4-((4-(2-pyrimidinylamino)phenyl)methyl)-
CAS No.:77916-97-3
Molecular Formula:C22H21 N5 O2
Molecular Weight:387.441
Hs Code.:2933990090
DSSTox Substance ID:DTXSID20228547
Wikidata:Q83108537
Mol file:77916-97-3.mol

Synonyms:77916-97-3;BRN 5644304;2,3-Piperazinedione, 1-(phenylmethyl)-4-((4-(2-pyrimidinylamino)phenyl)methyl)-;1-Benzyl-4-(4-(2-pyrimidinylamino)benzyl)-2,3-dioxopiperazine;1-(Phenylmethyl)-4-((4-(2-pyrimidinylamino)phenyl)methyl)-2,3-piperazinedione;1-(PHENYLMETHYL)-4-((4-(2-PYRIMIDINYLAMINO)PHENYL)METHYL)-2,3-PIPERAZI NEDIONE;1-benzyl-4-[4-(2-pyrimidinylamino)benzyl]-2,3-dioxopiperazine;SCHEMBL11044512;DTXSID20228547;ZCLGFADSFCRJBR-UHFFFAOYSA-N;LS-111906

Suppliers and Price of 2,3-Piperazinedione, 1-(phenylmethyl)-4-((4-(2-pyrimidinylamino)phenyl)methyl)-

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

American Custom Chemicals Corporation
1-(PHENYLMETHYL)-4-((4-(2-PYRIMIDINYLAMINO)PHENYL)METHYL)-2,3-PIPERAZI NEDIONE 95.00%
5MG
$ 497.57

Total 3 raw suppliers

Chemical Property of 2,3-Piperazinedione, 1-(phenylmethyl)-4-((4-(2-pyrimidinylamino)phenyl)methyl)-

Chemical Property:

Vapor Pressure:9.36E-15mmHg at 25°C
Boiling Point:608.6°C at 760 mmHg
Flash Point:321.9°C
PSA：78.43000
Density:1.332g/cm³
LogP:2.54000
XLogP3:2.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:6
Exact Mass:387.16952493
Heavy Atom Count:29
Complexity:551

Purity/Quality:

99% ^*data from raw suppliers

1-(PHENYLMETHYL)-4-((4-(2-PYRIMIDINYLAMINO)PHENYL)METHYL)-2,3-PIPERAZI NEDIONE 95.00% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1CN(C(=O)C(=O)N1CC2=CC=CC=C2)CC3=CC=C(C=C3)NC4=NC=CC=N4

Technology Process of 2,3-Piperazinedione, 1-(phenylmethyl)-4-((4-(2-pyrimidinylamino)phenyl)methyl)-

There total 4 articles about 2,3-Piperazinedione, 1-(phenylmethyl)-4-((4-(2-pyrimidinylamino)phenyl)methyl)- 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: 90.0%

: 100-44-7
benzyl chloride

: 77916-96-2
1-<4-(2-pyrimidinylamino)benzyl>-2,3-dioxopiperazine

: 77916-97-3
1-benzyl-4-<4-(2-pyrimidinylamino)benzyl>-2,3-dioxopiperazine

Guidance literature:: In N,N-dimethyl-formamide;

Reference yield:

: 77916-86-0
1-(4-aminobenzyl)-2,3-dioxopiperazine

: 77916-97-3
1-benzyl-4-<4-(2-pyrimidinylamino)benzyl>-2,3-dioxopiperazine

Guidance literature:: Multi-step reaction with 2 steps

1: 68.8 percent / dimethylformamide / 0.5 h / 130 - 140 °C

2: NaH

With sodium hydride; In N,N-dimethyl-formamide;
DOI:10.1248/cpb.29.1253

Reference yield:

: 78789-06-7
1-(4-nitrobenzyl)-2,3-dioxopiperazine

: 77916-97-3
1-benzyl-4-<4-(2-pyrimidinylamino)benzyl>-2,3-dioxopiperazine

Guidance literature:: Multi-step reaction with 3 steps

1: Zn-CaCl₂ / H₂O; ethanol

2: 68.8 percent / dimethylformamide / 0.5 h / 130 - 140 °C

3: NaH

With sodium hydride; calcium chloride; zinc; In ethanol; water; N,N-dimethyl-formamide;
DOI:10.1248/cpb.29.1253