1-[2-(4-Morpholinyl)ethyl]-3-(4-{(2E)-3-[6-(4-morpholinyl)-2-pyridinyl]-2-propenoyl}phenyl)urea | CAS No. 867164-40-7

1-[2-(4-Morpholinyl)ethyl]-3-(4-{(2E)-3-[6-(4-morpholinyl)-2-pyridinyl]-2-propenoyl}phenyl)urea

Basic Information

CAS Number

867164-40-7

Molecular Formula

C25H31N5O4

Molecular Weight

465.55 g/mol

AD

Basic Physical Properties

O=C(NCCN1CCOCC1)NC1=CC=C(C=C1)C(=O)C=CC1=NC(=CC=C1)N1CCOCC1

InChI

InChI=1S/C25H31N5O4/c31-23(9-8-21-2-1-3-24(27-21)30-14-18-34-19-15-30)20-4-6-22(7-5-20)28-25(32)26-10-11-29-12-16-33-17-13-29/h1-9H,10-19H2,(H2,26,28,32)

InChIKey

SQTSPANZQDCPLB-UHFFFAOYSA-N

LogP

2.268

Topological Polar Surface Area

96.03000000000002 Ų

Hydrogen Bond Donor/Acceptor

2 / 9

Complexity

670

Synonyms & References

English

  • N-[2-(4-Morpholinyl)ethyl]-N'-[4-[3-[6-(4-morpholinyl)-2-pyridinyl]-1-oxo-2-propen-1-yl]phenyl]urea
  • 1-(2-morpholin-4-ylethyl)-3-[4-[(E)-3-(6-morpholin-4-ylpyridin-2-yl)prop-2-enoyl]phenyl]urea
  • BCP29281
  • s8305
  • TRC051384

MDL Number

MFCD28133369

FAQ

What are the physical and chemical properties of 1-[2-(4-Morpholinyl)ethyl]-3-(4-{(2E)-3-[6-(4-morpholinyl)-2-pyridinyl]-2-propenoyl}phenyl)urea (CAS: 867164-40-7)?

The compound is a crystalline solid with a molecular weight of approximately 679.77 g/mol. It has a pKa of about 8.5 in aqueous solution. The compound is moderately soluble in water and ethanol. Chemically, it is reactive towards bases and readily undergoes hydrolysis. It is stable under normal storage conditions but should be protected from moisture and strong acids.

How is 1-[2-(4-Morpholinyl)ethyl]-3-(4-{(2E)-3-[6-(4-morpholinyl)-2-pyridinyl]-2-propenoyl}phenyl)urea (CAS: 867164-40-7) typically synthesized?

This compound is typically synthesized via a multistep process involving the reaction of 2-(4-morpholinylethyl)amine with 4-(2-propenoyl)-6-(4-morpholinyl)-2-pyridone. The synthesis requires careful control of reaction conditions, including temperature and pH, to achieve high yield and selectivity. Commonly used catalysts include Lewis acids or transition metal complexes.

What industries use 1-[2-(4-Morpholinyl)ethyl]-3-(4-{(2E)-3-[6-(4-morpholinyl)-2-pyridinyl]-2-propenoyl}phenyl)urea (CAS: 867164-40-7)?

This compound is primarily used in the pharmaceutical industry as an intermediate for drug synthesis. It also finds applications in the production of certain polymers and as a chemical sensor material due to its unique reactivity and functional groups. Its utility in semiconductors is less common but is explored in specialized research contexts.

What precautions should be taken when handling 1-[2-(4-Morpholinyl)ethyl]-3-(4-{(2E)-3-[6-(4-morpholinyl)-2-pyridinyl]-2-propenoyl}phenyl)urea (CAS: 867164-40-7)?

When handling this compound, it is essential to use appropriate personal protective equipment (PPE), including gloves, goggles, and a lab coat. Work should be conducted in a well-ventilated environment or fume hood. Spills should be cleaned up immediately with absorbent material and disposed of according to local regulations. Always refer to the Safety Data Sheet (SDS) for detailed handling and disposal instructions.

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