WZ4002 | CAS No. 1213269-23-8

WZ4002

Basic Information

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CAS Number

1213269-23-8

Molecular Formula

C25H27ClN6O3

Molecular Weight

494.98 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Ethers

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Fine Chemicals Dyes and Pigments Organic Dyes

Fine Chemicals Surfactants Anionic Surfactants

Agricultural Chemicals Pesticides Herbicides

Laboratory Chemicals Research Chemicals Biochemical Reagents

Basic Physical Properties

SMILES

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C=CC(=O)Nc1cccc(c1)Oc1nc(ncc1Cl)Nc1ccc(cc1OC)N1CCN(CC1)C

InChI

InChI=1S/C25H27ClN6O3/c1-4-23(33)28-17-6-5-7-19(14-17)35-24-20(26)16-27-25(30-24)29-21-9-8-18(15-22(21)34-3)32-12-10-31(2)11-13-32/h4-9,14-16H,1,10-13H2,2-3H3,(H,28,33)(H,27,29,30)

InChIKey

ITTRLTNMFYIYPA-UHFFFAOYSA-N

LogP

4.550800000000003

Topological Polar Surface Area

91.85 Å²

Hydrogen Bond Donor/Acceptor

2 / 9

Complexity

694

Safety Information

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Hazard Statement

H302 Harmful if swallowed
Acute toxicity, oral

H315 Causes skin irritation
Skin corrosion/irritation

H319 Causes serious eye irritation
Serious eye damage/eye irritation

H335 May cause respiratory irritation
Specific target organ toxicity, single exposure; Respiratory tract irritation

Synonyms & References

English

WZ4002
N-(3-(5-Chloro-2-(2-methoxy-4-(4-methylpiperazin-1-yl)phenylamino)pyrimidin-4-yloxy)phenyl)acrylamide
N-[3-[5-chloro-2-[2-methoxy-4-(4-methylpiperazin-1-yl)anilino]pyrimidin-4-yl]oxyphenyl]prop-2-enamide
WZ-4002
WZ4002(HBr)
N-{3-[(5-chloro-2-{[2-methoxy-4-(4-methylpiperazin-1-yl)phenyl]amino}pyrimidin-4-yl)oxy]phenyl}prop-2-enamide
WZ-4002,WZ4002
N-{3-[(5-Chloro-2-{[2-methoxy-4-(4-methyl-1-piperazinyl)phenyl]amino}-4-pyrimidinyl)oxy]phenyl}acrylamide
N-[3-[[5-Chloro-2-[[2-methoxy-4-(4-methyl-1-piperazinyl)phenyl]amino]-4-pyrimidinyl]oxy]phenyl]-2-propenamide
WZ 4002
6BQ432Z61M
SMR001913510
N-[3-[5-chloro-2-[2-methoxy-4-(4-methylpiperazin-1-yl)anilino]pyrimidin-4-yl

MDL Number

MFCD16621244

FAQ

What regulatory guidelines apply to WZ4002 (CAS: 1213269-23-8)?

WZ4002 (CAS: 1213269-23-8) is subject to regulatory guidelines under the Globally Harmonized System of Classification and Labelling of Chemicals (GHS), which includes classification for physical hazards, health hazards, and environmental hazards. Additionally, it must comply with REACH regulations in the European Union, which require registration, evaluation, authorization, and restriction of chemical substances. In the United States, it is subject to FDA regulations for pharmaceuticals and EPA regulations for environmental protection.

Are there alternatives to WZ4002 (CAS: 1213269-23-8) in synthesis?

There are several alternatives to WZ4002 (CAS: 1213269-23-8) in synthesis, including isomers and analogs such as WZ4001 and WZ4003, which may offer similar properties but with different physical and chemical characteristics. Common alternative reagents include other small molecules with similar functional groups, which can reduce the complexity and cost of the synthesis process.

What is the market or research trend for WZ4002 (CAS: 1213269-23-8)?

The market for WZ4002 (CAS: 1213269-23-8) is growing due to its potential applications in drug development and chemical research. Recent studies focus on its use as a lead compound in the development of new drugs for various diseases. The trend indicates increasing research into its synthesis and modification to improve its efficacy and reduce side effects. Market demand is also influenced by the rising need for innovative chemical products in pharmaceutical and biotech industries.

How should waste containing WZ4002 (CAS: 1213269-23-8) be handled?

Waste containing WZ4002 (CAS: 1213269-23-8) should be collected in appropriate containers lined with impermeable materials. The waste should then be disposed of through professional waste disposal services that are equipped to handle hazardous chemicals. Incineration is often used for the disposal of such waste under controlled conditions to minimize environmental impact. Environmental protection measures include ensuring that no hazardous substances are released into the air, water, or soil during the disposal process, and adhering to local and national regulations regarding chemical waste management.