3-Amino-6-[4-(methylsulfonyl)phenyl]-N-phenyl-2-pyrazinecarboxamide

Base Information

Chemical Name:3-Amino-6-[4-(methylsulfonyl)phenyl]-N-phenyl-2-pyrazinecarboxamide
CAS No.:1232410-49-9
Molecular Formula:C18H16N4O3S
Molecular Weight:368.416
Hs Code.:
Mol file:1232410-49-9.mol

Synonyms:3-Amino-6-[4-(methylsulfonyl)phenyl]-N-phenyl-2-pyrazinecarboxamide;VE-821;3-amino-6-(4-(methylsulfonyl)phenyl)-N-phenylpyrazine-2-carboxamide

Suppliers and Price of 3-Amino-6-[4-(methylsulfonyl)phenyl]-N-phenyl-2-pyrazinecarboxamide

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

Usbiological
VE 821
10mg
$ 446.00

TRC
VE821
10mg
$ 140.00

Tocris
VE821 ≥98%(HPLC)
25
$ 304.00

Sigma-Aldrich
ATR Inhibitor IV - CAS 1232410-49-10 - Calbiochem
10 mg
$ 211.00

Sigma-Aldrich
ATR Inhibitor IV - CAS 1232410-49-10 - Calbiochem
5049720001
$ 203.00

Medical Isotopes, Inc.
VE821
10 mg
$ 675.00

DC Chemicals
VE-821 >98%
1 g
$ 1600.00

DC Chemicals
VE-821 >98%
100 mg
$ 450.00

Crysdot
VE-821 98+%
50mg
$ 355.00

Crysdot
VE-821 98+%
100mg
$ 626.00

Total 55 raw suppliers

Chemical Property of 3-Amino-6-[4-(methylsulfonyl)phenyl]-N-phenyl-2-pyrazinecarboxamide

Chemical Property:

Boiling Point:568.4±50.0 °C(Predicted)
PKA:9.97±0.70(Predicted)
PSA：126.91000
Density:1.394
LogP:4.42760
Storage Temp.:-20°C
Solubility.:Soluble in DMSO (40 mg/ml)

Purity/Quality:

99%, ^*data from raw suppliers

VE 821 ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Description Ataxia-telangiectasia and Rad3-related protein (ATR) is a serine/threonine kinase that activates DNA processes related to the DNA damage response. VE-821 is an ATP-competitive inhibitor of ATR (IC50 = 26 nM). It augments DNA damage and cell death of cancer cells in response to radiation under normal and hypoxic conditions. VE-821 also sensitizes cancer cells to chemotherapy.
Uses VE 821 is a potent and selective inhibitor of DNA damage response kinase, ATR. VE 821 functions to disrupt DNA damage repair system of tumor cells, limiting their abilities for further growth. VE-821 has been used as an inhibitor of ATM- and Rad3-related (ATR) protein in human cancer cells.

Technology Process of 3-Amino-6-[4-(methylsulfonyl)phenyl]-N-phenyl-2-pyrazinecarboxamide

There total 6 articles about 3-Amino-6-[4-(methylsulfonyl)phenyl]-N-phenyl-2-pyrazinecarboxamide 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: 71.0%

: 1232423-29-8
3-amino-6-(4-(methylsulfonyl)phenyl)pyrazine-2-carboxylic acid

: 62-53-3
aniline

: 1232410-49-9
3-amino-6-(4-(methylsulfonyl)phenyl)-N-phenylpyrazine-2-carboxamide

Guidance literature:: With diethyl cyanophosphonate; triethylamine; In 1,2-dimethoxyethane; at 120 ℃; for 18h;

Reference yield:

: 36204-92-9
3-amino-6-bromo-N-phenyl-pyrazine-2-carboxamide

: 1232410-49-9
3-amino-6-(4-(methylsulfonyl)phenyl)-N-phenylpyrazine-2-carboxamide

Guidance literature:: With sodium carbonate; In water; N,N-dimethyl-formamide; at 88 ℃; for 18h; Inert atmosphere;
DOI:10.1021/jm101488z

Reference yield:

: 16298-03-6
Methyl 3-amino-2-pyrazinecarboxylate

: 1232410-49-9
3-amino-6-(4-(methylsulfonyl)phenyl)-N-phenylpyrazine-2-carboxamide

Guidance literature:: Multi-step reaction with 4 steps

1.1: N-Bromosuccinimide / acetonitrile / 18 h / 20 °C

2.1: lithium hydroxide / methanol; water / 2 h / Reflux

3.1: dmap; N-ethyl-N,N-diisopropylamine; 1,1'-carbonyldiimidazole / dimethyl sulfoxide / 0.5 h

3.2: 18 h / 20 °C

4.1: sodium carbonate / water; N,N-dimethyl-formamide / 18 h / 88 °C / Inert atmosphere

With dmap; N-Bromosuccinimide; sodium carbonate; N-ethyl-N,N-diisopropylamine; 1,1'-carbonyldiimidazole; lithium hydroxide; In methanol; water; dimethyl sulfoxide; N,N-dimethyl-formamide; acetonitrile; 4.1: Suzuki coupling;
DOI:10.1021/jm101488z