112809-54-8 | 4-(Imidazol-1-ylmethyl)benzonitrile

Packsize	Purity	Availability	Price	Discounted Price
1g	98%	in stock	$66.00	$46.00
5g	98%	in stock	$249.00	$175.00
10g	98%	in stock	$386.00	$270.00
25g	98%	in stock	$758.00	$531.00
100g	98%	in stock	$1,878.00	$1,315.00

Description

• Catalog Number: AE11728
• Chemical Name: 4-(Imidazol-1-ylmethyl)benzonitrile
• CAS Number: 112809-54-8
• Molecular Formula: C11H9N3
• Molecular Weight: 183.2093
• MDL Number: MFCD08060525
• SMILES: N#Cc1ccc(cc1)Cn1cncc1

Computed Properties

• Complexity: 222
• Covalently-Bonded Unit Count: 1
• Heavy Atom Count: 14
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• XLogP3: 1.3

Literature

• Synthesis and structure-activity relationship of 1- and 2-substituted-1,2,3-triazole letrozole-based analogues as aromatase inhibitors.

  European journal of medicinal chemistry 20110901

• Synthesis, biological evaluation, and molecular modeling of 1-benzyl-1H-imidazoles as selective inhibitors of aldosterone synthase (CYP11B2).

  Journal of medicinal chemistry 20100225

• Synthesis and biochemical evaluation of a range of sulfonated derivatives of 4-hydroxybenzyl imidazole as highly potent inhibitors of rat testicular 17alpha-hydroxylase/17,20-lyase (P-450(17alpha)).

  Bioorganic & medicinal chemistry letters 20090815

• Synthesis and biochemical evaluation of a range of potent benzyl imidazole-based compounds as potential inhibitors of the enzyme complex 17alpha-hydroxylase/17,20-lyase (P450(17alpha)).

  Bioorganic & medicinal chemistry letters 20060801

• Design and synthesis of potent nonpeptidic farnesyltransferase inhibitors based on a terphenyl scaffold.

  Journal of medicinal chemistry 20020103

• Fadrozole hydrochloride: a potent, selective, nonsteroidal inhibitor of aromatase for the treatment of estrogen-dependent disease.

  Journal of medicinal chemistry 19910201