FAAH-IN-2 | CAS No. 184475-71-6

FAAH-IN-2

Basic Information

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CAS Number

184475-71-6

Molecular Formula

C15H11ClFN3O2

Molecular Weight

319.72 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

Basic Physical Properties

Melting Point

>260°C (dec.)

Boiling Point

478.8°C at 760 mmHg

SMILES

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COC1=C(C=C2C(=C1)N=CN=C2NC3=CC(=C(C=C3)F)Cl)O

InChI

InChI=1S/C15H11ClFN3O2/c1-22-14-6-12-9(5-13(14)21)15(19-7-18-12)20-8-2-3-11(17)10(16)4-8/h2-7,21H,1H3,(H,18,19,20)

InChIKey

JLVTVCRXFMLUIF-UHFFFAOYSA-N

LogP

3.8801000000000005

Topological Polar Surface Area

67.27000000000001 Å²

Hydrogen Bond Donor/Acceptor

2 / 5

Complexity

379

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

XZ1
O-Desmorpholinopropyl Gefitinib
JLVTVCRXFMLUIF-UHFFFAOYSA-N
Des-Gefitinib
DTXSID40440527
V26QDI5C8D
s5329
4-[(3-Chloro-4-fluorophenyl)amino]-7-methoxyquinazolin-6-ol (O-Desmorpholinopropylgefitinib)
FAAH-IN-2
4-[(3-Chloro-4-fluorophenyl)amino]-7-methoxy-6-quinazolinol
6-Quinazolinol, 4-[(3-chloro-4-fluorophenyl)amino]-7-methoxy-
4-(3-Chloro-4-fluorophenylamino)-7-methoxyquinazolin-6-ol
184475-71-6
MFCD09908046
4-(3-Chloro-4-fluorophenylamino)-6-hydroxy-7-methoxyquinazoline
4,4-DIMETHYLDICYCLOHEXYLAMINE
4-[(3-chloro-4-fluorophenyl)amino]-7-methoxyquinazolin-6-ol
CCG-267695
A4084
CHEBI:143407
4-(3-chloro-4-fluoro-anilino)-7-methoxy-quinazolin-6-ol
Gefitinib metabolite M-295820
4-[(3-chloranyl-4-fluoranyl-phenyl)amino]-7-methoxy-quinazolin-6-ol
4-((3-Chloro-4-fluorophenyl)amino)-7-methoxyquinazolin-6-ol
4-(3'-chloro-4'-fluoroanilino)-6-hydroxy-7-methoxyquinazolin
NCGC00485886-01
BCP14414
4-(3'-chloro-4'-fluoroanilino)-6-hydroxy-7-methoxyquinazoline
4-(3-chloro-4-fluoroanilino)-6-hydroxy-7-methoxyquinazoline
HY-79511
AC-8513

MDL Number

MFCD09908046

Customs Code

2933990090

FAQ

What are the physical and chemical properties of FAAH-IN-2 (CAS: 184475-71-6)?

FAAH-IN-2 (CAS: 184475-71-6) is a crystalline compound with a molecular weight of approximately 411.45 g/mol. It has a high solubility in organic solvents such as dimethyl sulfoxide (DMSO) and poor solubility in water. Chemically, it is relatively stable but can undergo hydrolysis in the presence of water. It reacts with strong acids and bases to form stable salts.

How is FAAH-IN-2 (CAS: 184475-71-6) typically synthesized?

FAAH-IN-2 (CAS: 184475-71-6) is synthesized through a multi-step process involving the protection of an amine group, followed by alkylation, and subsequent deprotection. The reaction is typically conducted under mild conditions using a phase transfer catalyst to ensure high selectivity and yield. The final product undergoes rigorous purification to achieve high purity.

What industries use FAAH-IN-2 (CAS: 184475-71-6)?

FAAH-IN-2 (CAS: 184475-71-6) is primarily used in the pharmaceutical industry for the development of experimental compounds targeting the cannabinoid system. It is also used in academic research for studying the function of FAAH (fatty acid amide hydrolase) enzymes. This compound has potential applications in the field of biosensors for detecting cannabinoid levels in biological samples.

What precautions should be taken when handling FAAH-IN-2 (CAS: 184475-71-6)?

When handling FAAH-IN-2 (CAS: 184475-71-6), appropriate Personal Protective Equipment (PPE) such as gloves and safety goggles should be worn. It should be stored in a cool, dry place away from direct sunlight and heat sources. In case of a spill, use appropriate spill cleanup procedures as outlined in the Safety Data Sheet (SDS). Always ensure the area is well-ventilated and use a fume hood when necessary to minimize exposure to the compound.