Antitrypanosomal agent 1

Modify Date: 2024-01-13 17:48:20

Antitrypanosomal agent 1 Structure
Antitrypanosomal agent 1 structure
Common Name Antitrypanosomal agent 1
CAS Number 75144-12-6 Molecular Weight 282.59400
Density 1.22g/cm3 Boiling Point 341.9ºC at 760 mmHg
Molecular Formula C11H14Cl3NO Melting Point N/A
MSDS N/A Flash Point 160.6ºC

 Use of Antitrypanosomal agent 1


Antitrypanosomal agent 1 is a potent and selective trypanothione reductase (TR) inhibitor with an IC50 of 3.3 μM. Antitrypanosomal agent 1 inhibits glutathione reductase (GR) (IC50=64.8 μM) and T. brucei (EC50=1 μM). Antitrypanosomal agent 1 has anti-trypanosomal activity[1].

 Names

Name 1-(3,4-dichlorophenyl)-3-(dimethylamino)propan-1-one,hydrochloride
Synonym More Synonyms

 Antitrypanosomal agent 1 Biological Activity

Description Antitrypanosomal agent 1 is a potent and selective trypanothione reductase (TR) inhibitor with an IC50 of 3.3 μM. Antitrypanosomal agent 1 inhibits glutathione reductase (GR) (IC50=64.8 μM) and T. brucei (EC50=1 μM). Antitrypanosomal agent 1 has anti-trypanosomal activity[1].
Related Catalog
Target

IC50: 3.3 μM (trypanothione reductase) and 64.8 μM (glutathione reductase)[1] EC50: 1 μM (T. brucei)[1]

In Vitro Antitrypanosomal agent 1 (compound 8a) has an selectivity for TR (GR IC50/TR IC50) of 20[1].
References

[1]. Martyn DC, et al. High-throughput screening affords novel and selective trypanothione reductase inhibitors with anti-trypanosomal activity. Bioorg Med Chem Lett. 2007 Mar 1;17(5):1280-3.

 Chemical & Physical Properties

Density 1.22g/cm3
Boiling Point 341.9ºC at 760 mmHg
Molecular Formula C11H14Cl3NO
Molecular Weight 282.59400
Flash Point 160.6ºC
Exact Mass 281.01400
PSA 20.31000
LogP 3.92980
Index of Refraction 1.544
Storage condition 2-8℃

 Synthetic Route

~84%

Antitrypanosomal agent 1 Structure

Antitrypanosoma...

CAS#:75144-12-6

Literature: Shanghai Institute of Pharmaceutical Industry; Li, Jianqi; Zheng, Yongyong; Liao, Yunfeng; Li, Yali Patent: US2013/72488 A1, 2013 ; Location in patent: Paragraph 0165 ;

~49%

Antitrypanosomal agent 1 Structure

Antitrypanosoma...

CAS#:75144-12-6

Literature: Du, Xiaohui; Guo, Chun; Hansell, Elizabeth; Doyle, Patricia S.; Caffrey, Conor R.; Holler, Tod P.; McKerrow, James H.; Cohen, Fred E. Journal of Medicinal Chemistry, 2002 , vol. 45, # 13 p. 2695 - 2707

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Antitrypanosomal agent 1 Structure

Antitrypanosoma...

CAS#:75144-12-6

Literature: Shanghai Institute of Pharmaceutical Industry; Li, Jianqi; Zheng, Yongyong; Liao, Yunfeng; Li, Yali Patent: US2013/72488 A1, 2013 ;

 Synonyms

1-(3,4-Dichlorophenyl)-3-dimethylamino-1-propanone HCl
AmbscPOD_38/0850
1-(3,4-dichlorophenyl)-3-dimethylamino-1-propanone hydrochloride
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