N-{3-[(2-{[4-(4-Methyl-1-piperazinyl)phenyl]amino}thieno[3,2-d]pyrimidin-4-yl)oxy]phenyl}acrylamide | CAS No. 1353550-13-6

N-{3-[(2-{[4-(4-Methyl-1-piperazinyl)phenyl]amino}thieno[3,2-d]pyrimidin-4-yl)oxy]phenyl}acrylamide

Basic Information

CAS Number

1353550-13-6

Molecular Formula

C26H26N6O2S

Molecular Weight

486.6 g/mol

AD

Basic Physical Properties

Solubility

Insuluble (8.3E-3 g/L) (25 ºC),

C=CC(=O)Nc1cccc(c1)Oc1nc(Nc2ccc(cc2)N2CCN(CC2)C)nc2c1scc2

InChI

InChI=1S/C26H26N6O2S/c1-3-23(33)27-19-5-4-6-21(17-19)34-25-24-22(11-16-35-24)29-26(30-25)28-18-7-9-20(10-8-18)32-14-12-31(2)13-15-32/h3-11,16-17H,1,12-15H2,2H3,(H,27,33)(H,28,29,30)

InChIKey

FDMQDKQUTRLUBU-UHFFFAOYSA-N

LogP

5.103500000000004

Topological Polar Surface Area

82.61999999999999 Ų

Hydrogen Bond Donor/Acceptor

2 / 8

Complexity

712

Safety Information

View Safety Information

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

  • N-[3-[[2-[[4-(4-Methyl-1-piperazinyl)phenyl]amino]thieno[3,2-d]pyrimidin-4-yl]oxy]phenyl]-2-propenamide
  • Olmutinib
  • HM61713
  • BI 1482694
  • HM71224
  • CHL9B67L95
  • Olmutinib (HM61713, BI 1482694)
  • N-(3-((2-((4-(4-methylpiperazin-1-yl)phenyl)amino)thieno[3,2-d]pyrimidin-4-yl)oxy)phenyl)acrylamide
  • N-[3-[2-[4-(4-methylpiperazin-1-yl)anilino]thieno[3,2-d]pyrimidin-4-yl]oxyphenyl]prop-2-enamide
  • Olmutinib [INN]
  • 2-Propenamide, N-[3-[[2-[[4-(4-methyl-1-piperazinyl)phenyl]amino]thieno[3,2-d]pyrimidin-4-yl]oxy]phenyl]-
  • 2-Propenamide, N-(3-((2-((4-(4-methyl-1-piperazinyl

MDL Number

MFCD29918158

FAQ

What regulatory guidelines apply to N-{3-[(2-{[4-(4-Methyl-1-piperazinyl)phenyl]amino}thieno[3,2-d]pyrimidin-4-yl)oxy]phenyl}acrylamide (CAS: 1353550-13-6)?

N-{3-[(2-{[4-(4-Methyl-1-piperazinyl)phenyl]amino}thieno[3,2-d]pyrimidin-4-yl)oxy]phenyl}acrylamide (CAS: 1353550-13-6) falls under the scope of various regulatory guidelines. It must comply with the GHS (Globally Harmonized System of Classification and Labelling of Chemicals) for classification and labeling. REACH regulations in the EU also require the registration of substances above a certain tonnage. Additionally, FDA and EPA guidelines apply for the use and handling of this compound in the US, particularly regarding safety and environmental protection.

Are there alternatives to N-{3-[(2-{[4-(4-Methyl-1-piperazinyl)phenyl]amino}thieno[3,2-d]pyrimidin-4-yl)oxy]phenyl}acrylamide (CAS: 1353550-13-6) in synthesis?

There are several alternatives to N-{3-[(2-{[4-(4-Methyl-1-piperazinyl)phenyl]amino}thieno[3,2-d]pyrimidin-4-yl)oxy]phenyl}acrylamide (CAS: 1353550-13-6) in synthesis, including analogs such as other thieno[3,2-d]pyrimidine derivatives, isomers, and alternative reagents like substituted piperazines. These alternatives can offer different functionalities and may be more readily available or easier to handle in certain synthetic procedures.

What is the market or research trend for N-{3-[(2-{[4-(4-Methyl-1-piperazinyl)phenyl]amino}thieno[3,2-d]pyrimidin-4-yl)oxy]phenyl}acrylamide (CAS: 1353550-13-6)?

The market and research trends for N-{3-[(2-{[4-(4-Methyl-1-piperazinyl)phenyl]amino}thieno[3,2-d]pyrimidin-4-yl)oxy]phenyl}acrylamide (CAS: 1353550-13-6) are focused on its potential applications in pharmaceuticals and agrochemicals. There is an increasing interest in developing new chemical entities with specific biological activities. Research trends include investigating the compound's efficacy in treating various diseases and exploring its environmental impact and degradation mechanisms.

How should waste containing N-{3-[(2-{[4-(4-Methyl-1-piperazinyl)phenyl]amino}thieno[3,2-d]pyrimidin-4-yl)oxy]phenyl}acrylamide (CAS: 1353550-13-6) be handled?

Waste containing N-{3-[(2-{[4-(4-Methyl-1-piperazinyl)phenyl]amino}thieno[3,2-d]pyrimidin-4-yl)oxy]phenyl}acrylamide (CAS: 1353550-13-6) should be handled with care to prevent environmental contamination. Waste liquid should be collected and disposed of in accordance with local and international regulations. Incineration is a common method for disposal, but professional waste disposal services may be required. Environmental protection precautions include ensuring that waste is neutralized to a safe pH before disposal and that all necessary safety measures are followed to prevent exposure and further environmental harm.

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