1-(Naphthalen-2-yl)-3-(2-oxo-2-(pyrrolidin-1-yl)ethyl)urea

Base Information

Chemical Name:1-(Naphthalen-2-yl)-3-(2-oxo-2-(pyrrolidin-1-yl)ethyl)urea
CAS No.:1624117-53-8
Molecular Formula:C₁₇H₁₉N₃O₂
Molecular Weight:297.357
Hs Code.:
ChEMBL ID:CHEMBL4092167
Mol file:1624117-53-8.mol

Synonyms:1624117-53-8;XY1;1-(naphthalen-2-yl)-3-(2-oxo-2-(pyrrolidin-1-yl)ethyl)urea;N-2-Naphthalenyl-N'-[2-oxo-2-(1-pyrrolidinyl)ethyl]urea;1-(naphthalen-2-yl)-3-[2-oxo-2-(pyrrolidin-1-yl)ethyl]urea;1-naphthalen-2-yl-3-(2-oxo-2-pyrrolidin-1-ylethyl)urea;XY-1;CHEMBL4092167;EX-A785;BCP16719;ZPC11753;MFCD28397755;AKOS017213782;CS-5371;NCGC00387495-01;AC-35318;BS-15562;HY-19714;FT-0699837;S0184;EN300-211000;J-690226;Z409652006

Suppliers and Price of 1-(Naphthalen-2-yl)-3-(2-oxo-2-(pyrrolidin-1-yl)ethyl)urea

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

TRC
XY1
10mg
$ 145.00

Tocris
XY1 ≥98%(HPLC)
10
$ 154.00

Tocris
XY1 ≥98%(HPLC)
50
$ 645.00

DC Chemicals
XY1 >98%
1 g
$ 1800.00

DC Chemicals
XY1 >98%
250 mg
$ 900.00

CSNpharm
XY1
10mg
$ 140.00

Crysdot
XY1 98+%
50mg
$ 596.00

ChemScene
XY1 99.10%
10mg
$ 150.00

ChemScene
XY1 99.10%
5mg
$ 90.00

ChemScene
XY1 99.10%
100mg
$ 750.00

Total 20 raw suppliers

Chemical Property of 1-(Naphthalen-2-yl)-3-(2-oxo-2-(pyrrolidin-1-yl)ethyl)urea

Chemical Property:

Boiling Point:514.8±42.0 °C(Predicted)
PKA:12.62±0.46(Predicted)
Density:1.284±0.06 g/cm3(Predicted)
Storage Temp.:Sealed in dry,Store in freezer, under -20°C
XLogP3:2.2
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:3
Exact Mass:297.147726857
Heavy Atom Count:22
Complexity:407

Purity/Quality:

99%, ^*data from raw suppliers

XY1 ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:C1CCN(C1)C(=O)CNC(=O)NC2=CC3=CC=CC=C3C=C2
Description Protein arginine N-methyltransferase 3 (PRMT3, ) is a predominantly cytoplasmic enzyme that is constitutively expressed. SGC707 is a potent, selective allosteric inhibitor of PRMT3 (IC50 = 50 nM). It inhibits the methylation of histones in cells with an IC50 value below 1 μM. XY1 is a close analog of SGC707 that is completely inactive against PRMT3 at concentrations as high as 100 μM. It is intended to be used as a negative control for SGC707 in studies involving PRMT3 action. See the Structural Genomics Consortium (SGC) website for more information.
Uses XY1 acts as a close analog of SGC707 that is completely inactive against PRMT3, inhibiting the methylation of histones in cells.

Technology Process of 1-(Naphthalen-2-yl)-3-(2-oxo-2-(pyrrolidin-1-yl)ethyl)urea

There total 3 articles about 1-(Naphthalen-2-yl)-3-(2-oxo-2-(pyrrolidin-1-yl)ethyl)urea 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:

: ethyl (naphth-2-ylcarbamoyl)glycinate

: 1624117-53-8
1-(naphth-2-yl)-3-(2-oxo-2-(pyrrolidin-1-yl)ethyl)urea

Guidance literature:: Multi-step reaction with 3 steps

1: lithium hydroxide / tetrahydrofuran; water / 20 °C

2: thionyl chloride / 1,4-dioxane / 0.5 h / 80 °C

3: 1,4-dioxane / 20 °C

With thionyl chloride; lithium hydroxide; In tetrahydrofuran; 1,4-dioxane; water;
DOI:10.1002/anie.201412154

Reference yield:

: 91-59-8
naphthalen-2-ylamine

: 1624117-53-8
1-(naphth-2-yl)-3-(2-oxo-2-(pyrrolidin-1-yl)ethyl)urea

Guidance literature:: Multi-step reaction with 4 steps

1: dichloromethane / 20 °C

2: lithium hydroxide / tetrahydrofuran; water / 20 °C

3: thionyl chloride / 1,4-dioxane / 0.5 h / 80 °C

4: 1,4-dioxane / 20 °C

With thionyl chloride; lithium hydroxide; In tetrahydrofuran; 1,4-dioxane; dichloromethane; water;
DOI:10.1002/anie.201412154