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Home Bromides 839713-36-9
839713-36-9,MFCD16619341
Catalog No.:AA00G3PU

839713-36-9 | 1-[3-(4-Bromo-1-methyl-1h-pyrazol-5-yl)-4-methoxyphenyl]-3-(2,4-difluorophenyl)urea

Pack Size
Purity
Availability
Price(USD)
Quantity
  
100mg
97%
in stock  
$333.00   $233.00
- +
250mg
97%
in stock  
$614.00   $430.00
- +
1g
97%
in stock  
$1,463.00   $1,024.00
- +
  • Technical Information
  • Properties
  • Literature
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  • Technical Information
  • Properties
  • Literature
Technical Information
Catalog Number:
AA00G3PU
Chemical Name:
1-[3-(4-Bromo-1-methyl-1h-pyrazol-5-yl)-4-methoxyphenyl]-3-(2,4-difluorophenyl)urea
CAS Number:
839713-36-9
Molecular Formula:
C18H15BrF2N4O2
Molecular Weight:
437.2381
MDL Number:
MFCD16619341
SMILES:
COc1ccc(cc1c1c(Br)cnn1C)NC(=O)Nc1ccc(cc1F)F
Properties
Computed Properties
 
Complexity:
518  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
27  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Rotatable Bond Count:
4  
XLogP3:
3.3  

Literature

Title: Serotonin control of sleep-wake behavior.

Journal: Sleep medicine reviews 20110801

Title: Synthesis and in vivo evaluation of phenethylpiperazine amides: selective 5-hydroxytryptamine(2A) receptor antagonists for the treatment of insomnia.

Journal: Journal of medicinal chemistry 20100812

Title: Discovery of 1-[3-(4-bromo-2-methyl-2h-pyrazol-3-yl)-4-methoxyphenyl]-3-(2,4-difluorophenyl)urea (nelotanserin) and related 5-hydroxytryptamine2A inverse agonists for the treatment of insomnia.

Journal: Journal of medicinal chemistry 20100311

Title: Nelotanserin, a novel selective human 5-hydroxytryptamine2A inverse agonist for the treatment of insomnia.

Journal: The Journal of pharmacology and experimental therapeutics 20100101

Title: Al-Shamma HA et al. Nelotanserin, a novel selective human 5-hydroxytryptamine2A inverse agonist for the treatment of insomnia. J Pharmacol Exp Ther. 2010 Jan;332(1):281-90.

Title: Teegarden BR et al. Discovery of 1--(4-bromo-2-methyl-2h-pyrazol-3-yl)-4-methoxyphenyl-3-(2,4-difluorophenyl)urea (nelotanserin) and related 5-hydroxytryptamine2A inverse agonists for the treatment of insomnia. J Med Chem. 2010 Mar 11;53(5):1923-36.

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