N-{4-[(3-Chloro-4-fluorophenyl)amino]-7-[3-(4-morpholinyl)propoxy]-6-quinazolinyl}acrylamide

Basic Information

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CAS Number

267243-28-7

Molecular Formula

C24H25ClFN5O3

Molecular Weight

485.95 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

Fine Chemicals Specialty Chemicals UV Stabilizers

Agricultural Chemicals Pesticides Herbicides

Laboratory Chemicals Research Chemicals Biochemical Reagents

Basic Physical Properties

Physical State

Powder

Melting Point

188-190°

Boiling Point

691.0±55.0°C at 760 mmHg

Density

1.355

Flash Point

371.7 °C

Refractive Index

1.659

SMILES

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C=CC(=O)NC1=C(C=C2C(=C1)C(=NC=N2)NC3=CC(=C(C=C3)F)Cl)OCCCN4CCOCC4

InChI

InChI=1S/C24H25ClFN5O3/c1-2-23(32)30-21-13-17-20(14-22(21)34-9-3-6-31-7-10-33-11-8-31)27-15-28-24(17)29-16-4-5-19(26)18(25)12-16/h2,4-5,12-15H,1,3,6-11H2,(H,30,32)(H,27,28,29)

InChIKey

OMZCMEYTWSXEPZ-UHFFFAOYSA-N

LogP

4.391500000000003

Topological Polar Surface Area

88.61000000000001 Å²

Hydrogen Bond Donor/Acceptor

2 / 8

Complexity

671

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

NSC780019
NSC801011
EX-A078
NCGC00182713-02
CI-1033
N-(4-(3-chloro-4-fluorophenylamino)-7-(3-morpholinopropoxy)quinazolin-6-yl)acrylamide
BCP9000525
MLS004774146
Canertinib
HMS3244M18
Canertinib (CI-1033)
s1019
Canertinib free base
UNII-C78W1K5ASF
GTPL5675
NSC-780019
DB05424
N-{4-[(3-chloro-4-fluorophenyl)amino]-7-[3-(morpholin-4-yl)propoxy]quinazolin-6-yl}prop-2-enamide
FT-0654215
Z166624030
NCGC00182713-01
Canertinib [INN]
CI-1033(Canertinib)
cid_156414
CAS-267243-28-7
267243-28-7
BDBM4779
Canertinib [INN:BAN]
SMR003500789
A25038
N-[4-(3-chloro-4-fluoro-anilino)-7-(3-morpholinopropoxy)quinazolin-6-yl]prop-2-enamide

MDL Number

MFCD09837878

FAQ

What is N-{4-[(3-Chloro-4-fluorophenyl)amino]-7-[3-(4-morpholinyl)propoxy]-6-quinazolinyl}acrylamide (CAS: 267243-28-7)?

N-{4-[(3-Chloro-4-fluorophenyl)amino]-7-[3-(4-morpholinyl)propoxy]-6-quinazolinyl}acrylamide (CAS: 267243-28-7) is a complex organic compound with potential applications in the pharmaceutical industry. It contains a quinazoline ring, an acrylamide group, and a morpholine moiety, making it a versatile molecule for drug discovery and development.

What are the main uses of N-{4-[(3-Chloro-4-fluorophenyl)amino]-7-[3-(4-morpholinyl)propoxy]-6-quinazolinyl}acrylamide (CAS: 267243-28-7)?

N-{4-[(3-Chloro-4-fluorophenyl)amino]-7-[3-(4-morpholinyl)propoxy]-6-quinazolinyl}acrylamide (CAS: 267243-28-7) is primarily used as a lead compound in the development of therapeutic agents. Its unique chemical structure suggests potential applications in treating various diseases, including cancer and neurodegenerative disorders.

Is N-{4-[(3-Chloro-4-fluorophenyl)amino]-7-[3-(4-morpholinyl)propoxy]-6-quinazolinyl}acrylamide (CAS: 267243-28-7) safe?

N-{4-[(3-Chloro-4-fluorophenyl)amino]-7-[3-(4-morpholinyl)propoxy]-6-quinazolinyl}acrylamide (CAS: 267243-28-7) is a compound that requires specific handling due to its chemical nature. It should be used in a well-ventilated area and with appropriate personal protective equipment (PPE) to minimize exposure. Potential hazards include skin contact and inhalation. Follow all safety guidelines provided by the manufacturer.

How should N-{4-[(3-Chloro-4-fluorophenyl)amino]-7-[3-(4-morpholinyl)propoxy]-6-quinazolinyl}acrylamide (CAS: 267243-28-7) be stored?

N-{4-[(3-Chloro-4-fluorophenyl)amino]-7-[3-(4-morpholinyl)propoxy]-6-quinazolinyl}acrylamide (CAS: 267243-28-7) should be stored in a cool, dry place away from direct sunlight and heat sources. It should be kept in a tightly sealed container to prevent degradation. The storage temperature should be maintained between 15°C and 25°C, and the relative humidity should be kept below 60%.