4-[(4-Fluoro-2-methyl-1H-indol-5-yl)oxy]-6-methoxy-7-[3-(1-pyrrolidinyl)propoxy]quinazoline

Basic Information

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CAS Number

288383-20-0

Molecular Formula

C25H27FN4O3

Molecular Weight

450.51 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Ethers

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Fine Chemicals Specialty Chemicals UV Stabilizers

Agricultural Chemicals Pesticides Herbicides

Laboratory Chemicals Research Chemicals Biochemical Reagents

Basic Physical Properties

Boiling Point

626.557°C at 760 mmHg

SMILES

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CC1=CC2=C(N1)C=CC(=C2F)OC3=NC=NC4=CC(=C(C=C43)OC)OCCCN5CCCC5

InChI

InChI=1S/C25H27FN4O3/c1-16-12-17-19(29-16)6-7-21(24(17)26)33-25-18-13-22(31-2)23(14-20(18)27-15-28-25)32-11-5-10-30-8-3-4-9-30/h6-7,12-15,29H,3-5,8-11H2,1-2H3

InChIKey

XXJWYDDUDKYVKI-UHFFFAOYSA-N

LogP

5.224220000000004

Topological Polar Surface Area

72.5 Å²

Hydrogen Bond Donor/Acceptor

1 / 7

Complexity

625

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

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

Synonyms & References

English

UNII-NQU9IPY4K9
288383-20-0 (free base)
NSC755606
Quinazoline, 4-((4-fluoro-2-methyl-1H-indol-5-yl)oxy)-6-methoxy-7-(3-(1-pyrrolidinyl)propoxy)-
A24280
NSC800069
C25H27FN4O3
Cedirannib
GTPL5664
4-(4-fluoro-2-methylindol-5-yloxy)-6-methoxy-7-(3-(pyrrolidin-1-yl)propoxy)quinazoline
CEDIRANIB [MART.]
SCHEMBL63147
s1017
4-(4-Fluoro-2-methylindol-5-yloxy)-6-methoxy-7-[3-(pyrrolidin-1-yl)propoxy]quinazoline
AMY16021
Cediranib [USAN:INN:BAN]
SB16536
SMR004701223
Cediranib free base
BCP9000500
AZD2171, Cediranib
SW219261-1
Quinazoline,4-[(4-fluoro-2-methyl-1H-indol-5-yl)oxy]-6-methoxy-7-[3-(1-pyrrolidinyl)propoxy]-
ZD-2171
AKOS005145767
BRD-K86930074-001-01-9
Kinome_3318
HMS3654G05
Cediranib,AZD2171
Cediranib (AZD2171)
4-(4-Fluoro-2-methyl-1H-indol-5-yloxy)-6-methoxy-7-(3-pyrrolidin-1-yl-propoxy)-quinazoline

MDL Number

MFCD09954115

FAQ

What are the physical and chemical properties of 4-[(4-Fluoro-2-methyl-1H-indol-5-yl)oxy]-6-methoxy-7-[3-(1-pyrrolidinyl)propoxy]quinazoline (CAS: 288383-20-0)?

This compound is a quinazoline derivative with a molecular weight of approximately 554.57 g/mol. It exhibits good solubility in common organic solvents such as DMSO, ethanol, and acetone. Chemically, it is stable under normal conditions but can react with strong acids or bases. It crystallizes in the form of a white or off-white solid.

How is 4-[(4-Fluoro-2-methyl-1H-indol-5-yl)oxy]-6-methoxy-7-[3-(1-pyrrolidinyl)propoxy]quinazoline (CAS: 288383-20-0) typically synthesized?

This compound is synthesized through a multi-step process involving the coupling of 5-fluoro-2-methyl-1H-indole and 6-methoxy-7-(3-(1-pyrrolidinyl)propoxy)quinazoline-4-carbaldehyde. The reaction is catalyzed by palladium(II) acetate and tri-tert-butylphosphine, yielding a high selectivity and good overall yield.

What industries use 4-[(4-Fluoro-2-methyl-1H-indol-5-yl)oxy]-6-methoxy-7-[3-(1-pyrrolidinyl)propoxy]quinazoline (CAS: 288383-20-0)?

This compound has been utilized in the pharmaceutical industry for its potential anti-inflammatory and analgesic properties. It is also of interest in the development of new drug candidates for various diseases. Additionally, it may find applications in the polymer industry for its structural complexity and potential as a functional monomer.

What precautions should be taken when handling 4-[(4-Fluoro-2-methyl-1H-indol-5-yl)oxy]-6-methoxy-7-[3-(1-pyrrolidinyl)propoxy]quinazoline (CAS: 288383-20-0)?

When handling this compound, ensure proper personal protective equipment (PPE) such as gloves, goggles, and a lab coat. Use a fume hood to avoid inhalation of vapors. Store the compound in a cool, dry place away from direct sunlight and heat sources. In case of a spill, immediate action should be taken according to the Safety Data Sheet (SDS) guidelines.

Related Compounds

1,3-Dibromo-2,4-dichloro-5-fluorobenzene structure

Compound Q&A

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Compound Q&A

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NAMPT inhibitor-linker 1 (CAS: 2241019-57-6) is a chemical compound designed as ...

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Compound Q&A

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Compound Q&A

What is 1-(2-Chlorophenyl)-6-(3,3,3-trifluoro-2-methylpropyl)-1,5-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one (CAS: 794568-90-4)?

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Compound Q&A

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4-[(4-Fluoro-2-methyl-1H-indol-5-yl)oxy]-6-methoxy-7-[3-(1-pyrrolidinyl)propoxy]quinazoline | CAS No. 288383-20-0

Basic Information

CAS Number

Molecular Formula

Molecular Weight

Chemical Classification

Basic Physical Properties

Boiling Point

Chemical Properties

SMILES

InChI

InChIKey

LogP

Topological Polar Surface Area

Hydrogen Bond Donor/Acceptor

Complexity

Safety Information

Hazard Statement

Synonyms & References

English

MDL Number

FAQ

What are the physical and chemical properties of 4-[(4-Fluoro-2-methyl-1H-indol-5-yl)oxy]-6-methoxy-7-[3-(1-pyrrolidinyl)propoxy]quinazoline (CAS: 288383-20-0)?

How is 4-[(4-Fluoro-2-methyl-1H-indol-5-yl)oxy]-6-methoxy-7-[3-(1-pyrrolidinyl)propoxy]quinazoline (CAS: 288383-20-0) typically synthesized?

What industries use 4-[(4-Fluoro-2-methyl-1H-indol-5-yl)oxy]-6-methoxy-7-[3-(1-pyrrolidinyl)propoxy]quinazoline (CAS: 288383-20-0)?

What precautions should be taken when handling 4-[(4-Fluoro-2-methyl-1H-indol-5-yl)oxy]-6-methoxy-7-[3-(1-pyrrolidinyl)propoxy]quinazoline (CAS: 288383-20-0)?

Related Compounds

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