Thiourea, N-(5-bromo-2-pyridinyl)-N'-(2-(2-chloro-3-ethoxy-6-fluorophenyl)ethyl)-

Base Information

Chemical Name:Thiourea, N-(5-bromo-2-pyridinyl)-N'-(2-(2-chloro-3-ethoxy-6-fluorophenyl)ethyl)-
CAS No.:167683-61-6
Molecular Formula:C16H16 Br Cl F N3 O S
Molecular Weight:432.7381
Hs Code.:
DSSTox Substance ID:DTXSID70168348
Nikkaji Number:J778.033H
ChEMBL ID:CHEMBL398891
Mol file:167683-61-6.mol

Synonyms:Thiourea, N-(5-bromo-2-pyridinyl)-N'-(2-(2-chloro-3-ethoxy-6-fluorophenyl)ethyl)-;167683-61-6;N-(2-(2-Chloro-3-ethoxy-6-fluorophenethyl))-N'-(2-(5-bromopyridyl))thiourea;PETT deriv. 9;N-[2-(2-Chloro-3-ethoxy-6-fluorophenethyl)]-N'-[2-(5-bromopyridyl)]thiourea;Thiourea, N-(5-bromo-2-pyridinyl)-N'-[2-(2-chloro-3-ethoxy-6-fluorophenyl)ethyl]-;D06KXS;BDBM2859;CHEMBL398891;SCHEMBL6906082;DTXSID70168348;1-(5-bromopyridin-2-yl)-3-[2-(2-chloro-3-ethoxy-6-fluorophenyl)ethyl]thiourea;1-(5-bromo-2-pyridyl)-3-[2-(2-chloro-3-ethoxy-6-fluoro-phenyl)ethyl]thiourea;N-(5-Bromo-2-pyridyl)-N'-[2-(2-chloro-6-fluoro-3-ethoxyphenyl)ethyl]thiourea

Suppliers and Price of Thiourea, N-(5-bromo-2-pyridinyl)-N'-(2-(2-chloro-3-ethoxy-6-fluorophenyl)ethyl)-

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 4 raw suppliers

Chemical Property of Thiourea, N-(5-bromo-2-pyridinyl)-N'-(2-(2-chloro-3-ethoxy-6-fluorophenyl)ethyl)-

Chemical Property:

Vapor Pressure:1.52E-10mmHg at 25°C
Boiling Point:510.6°Cat760mmHg
Flash Point:262.6°C
Density:1.531g/cm³
XLogP3:4.5
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:6
Exact Mass:430.98700
Heavy Atom Count:24
Complexity:410

Purity/Quality:: 99% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CCOC1=C(C(=C(C=C1)F)CCNC(=S)NC2=NC=C(C=C2)Br)Cl

Technology Process of Thiourea, N-(5-bromo-2-pyridinyl)-N'-(2-(2-chloro-3-ethoxy-6-fluorophenyl)ethyl)-

There total 5 articles about Thiourea, N-(5-bromo-2-pyridinyl)-N'-(2-(2-chloro-3-ethoxy-6-fluorophenyl)ethyl)- 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:

: 1996-41-4
2-chloro-4-fluorophenol

: 167683-61-6
N-(2-Chloro-3-ethoxy-6-fluorophenethyl)-N'-(5-bromopyrid-2-yl)-thiourea

Guidance literature:: Multi-step reaction with 5 steps

1: 96 percent / K₂CO₃ / acetone / 5 h / 60 °C

2: 1.) hexane, THF, -65 deg C, 0.5 h, 2.) hexane, THF, from -65 deg C to RT

3: 1.) NaOH, 2.) 4N aq. HCl / 1.) H₂O, methanol, -3 deg C, 15 min

4: 84 percent / LiAlH₄ / tetrahydrofuran / 2 h / Heating

5: 80 - 100 °C

With tetrahydrofuran; hydrogenchloride; sodium hydroxide; lithium aluminium tetrahydride; hexane; from -65 deg C to RT; potassium carbonate; In tetrahydrofuran; acetone;
DOI:10.1021/jm950639r

Reference yield:

: 181305-71-5
1-chloro-2-ethoxy-5-fluorobenzene

: 167683-61-6
N-(2-Chloro-3-ethoxy-6-fluorophenethyl)-N'-(5-bromopyrid-2-yl)-thiourea

Guidance literature:: Multi-step reaction with 4 steps

1: 1.) hexane, THF, -65 deg C, 0.5 h, 2.) hexane, THF, from -65 deg C to RT

2: 1.) NaOH, 2.) 4N aq. HCl / 1.) H₂O, methanol, -3 deg C, 15 min

3: 84 percent / LiAlH₄ / tetrahydrofuran / 2 h / Heating

4: 80 - 100 °C

With tetrahydrofuran; hydrogenchloride; sodium hydroxide; lithium aluminium tetrahydride; hexane; from -65 deg C to RT; In tetrahydrofuran;
DOI:10.1021/jm950639r

Reference yield:

: 181305-73-7
2-chloro-3-ethoxy-6-fluorobenzaldehyde

: 167683-61-6
N-(2-Chloro-3-ethoxy-6-fluorophenethyl)-N'-(5-bromopyrid-2-yl)-thiourea

Guidance literature:: Multi-step reaction with 3 steps

1: 1.) NaOH, 2.) 4N aq. HCl / 1.) H₂O, methanol, -3 deg C, 15 min

2: 84 percent / LiAlH₄ / tetrahydrofuran / 2 h / Heating

3: 80 - 100 °C

With hydrogenchloride; sodium hydroxide; lithium aluminium tetrahydride; In tetrahydrofuran;
DOI:10.1021/jm950639r