LY294002 | CAS No. 154447-36-6

LY294002

Basic Information

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CAS Number

154447-36-6

Molecular Formula

C19H17NO3

Molecular Weight

307.35 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

Basic Physical Properties

Melting Point

182.0 to 186.0 deg-C

Boiling Point

494.6°C at 760 mmHg

Water Solubility

Soluble in DMSO at 5mg/ml. Insoluble in water

Flash Point

253oC

Solubility

DMSO: >5 mg/mL

SMILES

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O=c1cc(oc2c(cccc12)c3ccccc3)N4CCOCC4

InChI

InChI=1S/C19H17NO3/c21-17-13-18(20-9-11-22-12-10-20)23-19-15(7-4-8-16(17)19)14-5-2-1-3-6-14/h1-8,13H,9-12H2

InChIKey

CZQHHVNHHHRRDU-UHFFFAOYSA-N

LogP

3.2966000000000024

Topological Polar Surface Area

42.68000000000001 Å²

Hydrogen Bond Donor/Acceptor

0 / 4

Complexity

463

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

H332 Harmful if inhaled
Acute toxicity, inhalation

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

Synonyms & References

English

2-(4-Morpholinyl)-8-phenyl-4H-1-benzopyran-4-one hydrochloride
LY 294002 hydrochloride
2-Morpholino-8-phenylchromone
LY 294002
2-Morpholino-8-phenyl-4H-chromen-4-one
LY240092
LY-294002
2-Morpholino-8-phenyl-4-oxo-4H-1-benzopyran
NSC 697286
SF 1101
8-Phenyl-2-(morpholin-4-yl)chromen-4-one
2-(4-Morpholinyl)-8-phenyl-4H-1-benzopyran-4-one
LY294002HCl
LY294002 (HCI Salt)
LY294002, NSC 697286
InSolution? LY 294002
LY 294002, 99+%
LY294002
2-morpholin-4-yl-8-phenyl-4H-chromen-4-one
2-(morpholin-4-yl)-8-phenyl-4H-chromen-4-one
31M2U1DVID
2-MORPHOLIN-4-YL-7-PHENYL-4H-CHROMEN-4-ONE
4H-1-Benzopyran-4-one, 2-(4-morpholinyl)-8-phenyl-
InSolution™ LY 294002
2-morpholino-8-phenyl-chromen-4-one
AK162301
2-(morpholin-4-yl)-8-phenylchro
LY 294002 HYDROCHLORIDE

MDL Number

MFCD00270881

FAQ

What are the physical and chemical properties of LY294002 (CAS: 154447-36-6)?

LY294002 is a white to off-white crystalline powder with a molecular weight of approximately 396.27 g/mol. It is sparingly soluble in water but readily soluble in organic solvents like DMSO and ethanol. Chemically, it is known for its high reactivity, particularly in phosphate kinase inhibition studies.

How is LY294002 (CAS: 154447-36-6) typically synthesized?

LY294002 is typically synthesized through a multi-step organic reaction involving the condensation of an amide with an aldehyde followed by subsequent functional group manipulations. Common catalysts include Lewis acids, and the reaction is carried out in polar aprotic solvents such as DMF. The overall yield is around 60-70%, with high selectivity for the desired product.

What industries use LY294002 (CAS: 154447-36-6)?

LY294002 is primarily used in the pharmaceutical industry for its role as a selective phosphatidylinositol 3-kinase (PI3K) inhibitor. It is also utilized in academic and industrial research for studying cellular signaling pathways and in the development of potential therapeutics for diseases such as cancer and autoimmune disorders.

What precautions should be taken when handling LY294002 (CAS: 154447-36-6)?

When handling LY294002, it is essential to wear appropriate personal protective equipment (PPE), including gloves and safety goggles. Work should be carried out in a well-ventilated area or a fume hood to minimize inhalation risk. Spills should be cleaned up using appropriate tools and materials, and disposal should follow local regulations. Always consult the Safety Data Sheet (SDS) for detailed handling and safety information.