4-Phenoxybenzylamine

Modify Date: 2024-01-04 16:48:44

4-Phenoxybenzylamine Structure
4-Phenoxybenzylamine structure
Common Name 4-Phenoxybenzylamine
CAS Number 107622-80-0 Molecular Weight 199.248
Density 1.1±0.1 g/cm3 Boiling Point 319.6±25.0 °C at 760 mmHg
Molecular Formula C13H13NO Melting Point N/A
MSDS USA Flash Point 149.5±16.4 °C

 Use of 4-Phenoxybenzylamine


4-Phenoxybenzylamine inhibits the function of the NS3 protein by stabilizing an inactive conformation with an IC50 of about 500 μM against FL NS3/4a.

 Names

Name 4-Phenoxybenzylamine
Synonym More Synonyms

 4-Phenoxybenzylamine Biological Activity

Description 4-Phenoxybenzylamine inhibits the function of the NS3 protein by stabilizing an inactive conformation with an IC50 of about 500 μM against FL NS3/4a.
Related Catalog
Target

IC50: 500 μM (FL NS3/4a)[1]

In Vitro A highly conserved novel binding site located at the interface between the protease and helicase domains of the Hepatitis C Virus (HCV) NS3 protein is identified. 4-Phenoxybenzylamine binding at this allosteric site inhibits the function of the NS3 protein by stabilizing an inactive conformation and thus represents a new class of direct acting antiviral agents[1].
References

[1]. Saalau-Bethell SM, et al. Discovery of an allosteric mechanism for the regulation of HCV NS3 protein function. Nat Chem Biol. 2012 Nov;8(11):920-5.

 Chemical & Physical Properties

Density 1.1±0.1 g/cm3
Boiling Point 319.6±25.0 °C at 760 mmHg
Molecular Formula C13H13NO
Molecular Weight 199.248
Flash Point 149.5±16.4 °C
Exact Mass 199.099716
PSA 35.25000
LogP 3.08
Vapour Pressure 0.0±0.7 mmHg at 25°C
Index of Refraction 1.595

 Safety Information

Hazard Codes C: Corrosive;Xi: Irritant;
Risk Phrases R36/37/38
Safety Phrases 26-36/37/39
HS Code 2922299090

 Synthetic Route

~45%

4-Phenoxybenzylamine Structure

4-Phenoxybenzylamine

CAS#:107622-80-0

Literature: Fotsch; Sonnenberg; Chen; Hale; Karbon; Norman Journal of Medicinal Chemistry, 2001 , vol. 44, # 14 p. 2344 - 2356

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4-Phenoxybenzylamine Structure

4-Phenoxybenzylamine

CAS#:107622-80-0

Literature: Journal of Medicinal Chemistry, , vol. 44, # 14 p. 2344 - 2356

~%

4-Phenoxybenzylamine Structure

4-Phenoxybenzylamine

CAS#:107622-80-0

Literature: Journal of Medicinal Chemistry, , vol. 44, # 14 p. 2344 - 2356

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4-Phenoxybenzylamine Structure

4-Phenoxybenzylamine

CAS#:107622-80-0

Literature: Bioorganic and Medicinal Chemistry, , vol. 17, # 4 p. 1428 - 1436

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4-Phenoxybenzylamine Structure

4-Phenoxybenzylamine

CAS#:107622-80-0

Literature: Pharmaceutical Bulletin, , vol. 5, p. 397,399

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4-Phenoxybenzylamine Structure

4-Phenoxybenzylamine

CAS#:107622-80-0

Literature: Pharmaceutical Bulletin, , vol. 5, p. 397,399

 Customs

HS Code 2922299090
Summary 2922299090. other amino-naphthols and other amino-phenols, other than those containing more than one kind of oxygen function, their ethers and esters; salts thereof. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:30.0%

 Synonyms

(4-Phenoxyphenyl)methanamine
MFCD01310836
Benzenemethanamine, 4-phenoxy-
1-(4-Phenoxyphenyl)methanamine