3-Methyl-L-valyl-(4R)-4-hydroxy-N-[4-(4-methyl-1,3-thiazol-5-yl)benzyl]-L-prolinamide hydrochloride (1:1) | CAS No. 1448189-80-7

3-Methyl-L-valyl-(4R)-4-hydroxy-N-[4-(4-methyl-1,3-thiazol-5-yl)benzyl]-L-prolinamide hydrochloride (1:1)

Basic Information

CAS Number

1448189-80-7

Molecular Formula

C22H31ClN4O3S

Molecular Weight

467.04 g/mol

AD

Basic Physical Properties

Cl.Cc1ncsc1c2ccc(CNC(=O)[C@@H]3C[C@@H](O)CN3C(=O)[C@@H](N)C(C)(C)C)cc2

InChI

InChI=1S/C22H30N4O3S.ClH/c1-13-18(30-12-25-13)15-7-5-14(6-8-15)10-24-20(28)17-9-16(27)11-26(17)21(29)19(23)22(2,3)4;/h5-8,12,16-17,19,27H,9-11,23H2,1-4H3,(H,24,28);1H/t16-,17+,19-;/m1./s1

InChIKey

JYRTWGCWUBURGU-MSSRUXLCSA-N

LogP

2.49172

Topological Polar Surface Area

108.55 Ų

Hydrogen Bond Donor/Acceptor

4 / 7

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

  • Protein degrader 1 (hydrochloride)
  • Protein degrader 1 hydrochloride
  • 3-Methyl-L-valyl-(4R)-4-hydroxy-N-[4-(4-methyl-1,3-thiazol-5-yl)benzyl]-L-prolinamide hydrochloride (1:1)
  • (2s,4r)-1-((s)-2-amino-3,3-dimethylbutanoyl)-4-hydroxy-n-(4-(4-methylthiazol-5-yl)benzyl)pyrrolidine-2-carboxamide hydrochloride
  • E3 Ligase ligand
  • VH032
  • (S,R,S)-AHPC hydrochloride
  • (S,R,S)-AHPC monohydrochloride

MDL Number

MFCD30502992

FAQ

What are the physical and chemical properties of 3-Methyl-L-valyl-(4R)-4-hydroxy-N-[4-(4-methyl-1,3-thiazol-5-yl)benzyl]-L-prolinamide hydrochloride (CAS: 1448189-80-7)?

This compound is a hydrochloride salt with a crystalline form. Its molecular weight is approximately 638.85 g/mol. It has a high water solubility, making it suitable for aqueous solutions. The compound exhibits moderate reactivity typical of amide compounds, with potential for hydrolysis under basic conditions. It is stable under normal storage conditions but should be protected from moisture and air.

How is 3-Methyl-L-valyl-(4R)-4-hydroxy-N-[4-(4-methyl-1,3-thiazol-5-yl)benzyl]-L-prolinamide hydrochloride (CAS: 1448189-80-7) typically synthesized?

The compound is synthesized through a multi-step process involving peptide coupling and amidation reactions. Commonly, it is prepared from 3-methyl-L-valine, (4R)-4-hydroxy-L-proline, and 4-(4-methyl-1,3-thiazol-5-yl)benzyl chloride. The synthesis involves careful control of reaction conditions to achieve high yield and selectivity, often using appropriate solvents and catalysts.

What industries use 3-Methyl-L-valyl-(4R)-4-hydroxy-N-[4-(4-methyl-1,3-thiazol-5-yl)benzyl]-L-prolinamide hydrochloride (CAS: 1448189-80-7)?

This compound is primarily used in the pharmaceutical industry for its potential biological activities. It may also find applications in the development of new materials, such as polymers with specific properties, and as a reagent in chemical research. Its unique structure makes it valuable for studying biomolecular interactions and developing new therapeutic agents.

What precautions should be taken when handling 3-Methyl-L-valyl-(4R)-4-hydroxy-N-[4-(4-methyl-1,3-thiazol-5-yl)benzyl]-L-prolinamide hydrochloride (CAS: 1448189-80-7)?

When handling this compound, it is important to use appropriate personal protective equipment (PPE) such as gloves, goggles, and a lab coat. Work should be conducted in a well-ventilated area or a fume hood to minimize inhalation risk. Spills should be cleaned up using appropriate absorbent materials and the area should be rinsed thoroughly. Always refer to the Safety Data Sheet (SDS) for specific handling and disposal guidelines.

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