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72702-95-5,MFCD00204117
Catalog No.:AA005PQT

72702-95-5 | Statil

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1mg
97%
in stock  
$9.00   $7.00
- +
10mg
97%
in stock  
$44.00   $31.00
- +
100mg
97%
in stock  
$170.00   $119.00
- +
250mg
97%
in stock  
$311.00   $218.00
- +
1g
97%
in stock  
$760.00   $532.00
- +
5g
97%
in stock  
$2,256.00   $1,580.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA005PQT
Chemical Name:
Statil
CAS Number:
72702-95-5
Molecular Formula:
C17H12BrFN2O3
Molecular Weight:
391.1912
MDL Number:
MFCD00204117
SMILES:
OC(=O)Cc1nn(Cc2ccc(cc2F)Br)c(=O)c2c1cccc2
Properties
Properties
 
Form:
Solid  
MP:
184-186℃ (DEC.)  
Storage:
Keep in dry area;-20 ℃;  

Computed Properties
 
Complexity:
542  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
24  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
4  
XLogP3:
3.2  

Downstream Synthesis Route
72702-95-5    75-36-5   
methyl2-(2-fluoro-4-bromobenzyl)-1,2-dihydro-1-oxophthalazin-4-ylacetate 

[1]Patent:US4251528,1981,A

72702-95-5   
petrol 
 
sodium2-(2-fluoro-4-bromobenzyl)-1,2-dihydro-1-oxophthalazin-4-ylacetate 

[1]Patent:US4251528,1981,A

[1]ChemicalBiologyandDrugDesign,2010,vol.75,p.381-391

[1]ChemicalBiologyandDrugDesign,2010,vol.75,p.381-391

Literature

Title: Aldo-keto reductases protect lung adenocarcinoma cells from the acute toxicity of B[a]P-7,8-trans-dihydrodiol.

Journal: Chemical research in toxicology 20120113

Title: Synthesis and antimycobacterial evaluation of novel Phthalazin-4-ylacetamides against log- and starved phase cultures.

Journal: Chemical biology & drug design 20100401

Title: Structure of human aldose reductase holoenzyme in complex with statil: an approach to structure-based inhibitor design of the enzyme.

Journal: Proteins 20030201

Title: A comparison of quantitative NMR and radiolabelling studies of the metabolism and excretion of Statil (3-(4-bromo-2-fluorobenzyl)-4-oxo-3H-phthalazin-1-ylacetic acid) in the rat.

Journal: Journal of pharmaceutical and biomedical analysis 20020401

Title: Molecular modeling of the aldose reductase-inhibitor complex based on the X-ray crystal structure and studies with single-site-directed mutants.

Journal: Journal of medicinal chemistry 20000323

Title: Effect of lipoprotein lipase activators bezafibrate and NO-1886, on B16 melanoma-induced cachexia in mice.

Journal: Anticancer research 19990101

Title: Aldose reductase inhibitors: a potential new class of agents for the pharmacological control of certain diabetic complications.

Journal: Journal of medicinal chemistry 19850701

Title: Ward WH, et al. Ponalrestat: a potent and specific inhibitor of aldose reductase. Biochem Pharmacol. 1990 Jan 15;39(2):337-46.

Title: Bresson E, et al. The human aldose reductase AKR1B1 qualifies as the primary prostaglandin F synthase in the endometrium. J Clin Endocrinol Metab. 2011 Jan;96(1):210-9.

Title: Calcutt NA, et al. Prevention of sensory disorders in diabetic Sprague-Dawley rats by aldose reductase inhibition or treatment with ciliary neurotrophic factor. Diabetologia. 2004 Apr;47(4):718-24.

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