N-(4-Fluorophenyl)-4,5-dimethyl-6-(1-methyl-3,4-dihydro-2(1H)-isoquinolinyl)-2-pyrimidinamine hydrochloride (1:1) | CAS No. 178307-42-1

N-(4-Fluorophenyl)-4,5-dimethyl-6-(1-methyl-3,4-dihydro-2(1H)-isoquinolinyl)-2-pyrimidinamine hydrochloride (1:1)

Basic Information

CAS Number

178307-42-1

Molecular Formula

C22H24ClFN4

Molecular Weight

398.91 g/mol

AD

Basic Physical Properties

Melting Point

205-208°

Cc1c(nc(nc1N2CCc3ccccc3C2C)Nc4ccc(cc4)F)C.Cl

InChI

InChI=1S/C22H23FN4.ClH/c1-14-15(2)24-22(25-19-10-8-18(23)9-11-19)26-21(14)27-13-12-17-6-4-5-7-20(17)16(27)3;/h4-11,16H,12-13H2,1-3H3,(H,24,25,26);1H

InChIKey

MALPZYQJEDBIAK-UHFFFAOYSA-N

LogP

5.521640000000004

Topological Polar Surface Area

41.050000000000004 Ų

Hydrogen Bond Donor/Acceptor

1 / 4

Synonyms & References

English

  • Revanex
  • 2-PYRIMIDINAMINE, 4-(3,4-DIHYDRO-1-METHYL-2(1H)-ISOQUINOLINYL)-N-(4-FLUOROPHENYL)-5,6-DIMETHYL-, MONOHYDROCHLORIDE
  • Revaprazan Hydrochlo
  • Revaprazan hydrochloride
  • Revaprazan HCL
  • 5,6-Dimethyl-2-(4-fluorophenylamino)-4-(1-methyl-1,2,3,4-tetrahydroisoquinolin-2-yl)pyrimidine hydrochloride
  • YH 1885
  • SB 641257
  • SB 641257A
  • YH 1885-d3
  • SB 641257A-d3
  • SB 641257 HCl
  • SB 641257 Hydrochloride
  • N-(4-fluorophenyl)-4,5-dimethyl-6-(1-methyl-3,4-dihydroisoquinolin-2(1H)-yl)pyrimidin-2-amine
  • hydrochloride (1:1)

MDL Number

MFCD09955384

FAQ

What regulatory guidelines apply to N-(4-Fluorophenyl)-4,5-dimethyl-6-(1-methyl-3,4-dihydro-2(1H)-isoquinolinyl)-2-pyrimidinamine hydrochloride (CAS: 178307-42-1)?

This compound falls under multiple regulatory categories. According to the Globally Harmonized System of Classification and Labelling of Chemicals (GHS), it may require specific hazard communication and labeling. In Europe, REACH regulations apply, requiring registration if imported or manufactured in large quantities. Additionally, FDA and EPA regulations may apply in the United States for its use in pharmaceuticals or environmental releases.

Are there alternatives to N-(4-Fluorophenyl)-4,5-dimethyl-6-(1-methyl-3,4-dihydro-2(1H)-isoquinolinyl)-2-pyrimidinamine hydrochloride (CAS: 178307-42-1) in synthesis?

Several alternatives can be considered in synthesis, such as using similar dimethyl pyrimidinamines or isoquinolines with different substituents. Other reagents like 4-fluorophenyl derivatives or related isoquinolines can also serve as effective substitutes, depending on the desired properties and reaction conditions.

What is the market or research trend for N-(4-Fluorophenyl)-4,5-dimethyl-6-(1-methyl-3,4-dihydro-2(1H)-isoquinolinyl)-2-pyrimidinamine hydrochloride (CAS: 178307-42-1)?

Research trends indicate increasing interest in this compound due to its potential in medicinal chemistry and anti-inflammatory applications. Market demand is expected to grow with advancements in drug development and clinical trials. Emerging research focuses on optimizing synthesis routes and exploring its pharmacological properties.

How should waste containing N-(4-Fluorophenyl)-4,5-dimethyl-6-(1-methyl-3,4-dihydro-2(1H)-isoquinolinyl)-2-pyrimidinamine hydrochloride (CAS: 178307-42-1) be handled?

Waste containing this compound should be collected in appropriate containers and stored separately. For disposal, incineration is a recommended method, followed by professional waste disposal services. Ensure proper environmental protection measures are in place to prevent contamination, and consult local regulations for specific disposal requirements.

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