613-93-4 | N-Methylbenzamide

Packsize	Purity	Availability	Price	Discounted Price
1g	97%	in stock	$9.00	$6.00
5g	97%	in stock	$28.00	$19.00
10g	97%	in stock	$53.00	$37.00
25g	97%	in stock	$129.00	$90.00
100g	97%	in stock	$386.00	$270.00
500g	97%	in stock	$1,380.00	$966.00

Description

• Catalog Number: AB77609
• Chemical Name: N-Methylbenzamide
• CAS Number: 613-93-4
• Molecular Formula: C8H9NO
• Molecular Weight: 135.1632
• MDL Number: MFCD00011642
• SMILES: CNC(=O)c1ccccc1
• NSC Number: 42944

Computed Properties

• Complexity: 116
• Covalently-Bonded Unit Count: 1
• Heavy Atom Count: 10
• Hydrogen Bond Acceptor Count: 1
• Hydrogen Bond Donor Count: 1
• Rotatable Bond Count: 1
• XLogP3: 0.9

Literature

• 3D-QSAR studies on CCR2B receptor antagonists: Insight into the structural requirements of (R)-3-aminopyrrolidine series of molecules based on CoMFA/CoMSIA models.

  Journal of pharmacy & bioallied sciences 20120101

• A functionalized enol lactone containing a protected α-amino acid.

  Acta crystallographica. Section E, Structure reports online 20101201

• Discovery and in vitro and in vivo profiles of 4-fluoro-N-[4-[6-(isopropylamino)pyrimidin-4-yl]-1,3-thiazol-2-yl]-N-methylbenzamide as novel class of an orally active metabotropic glutamate receptor 1 (mGluR1) antagonist.

  Bioorganic & medicinal chemistry letters 20090915

• Study of the Beckmann rearrangement of acetophenone oxime over porous solids by means of solid state NMR spectroscopy.

  Physical chemistry chemical physics : PCCP 20090707

• DG-AMMOS: a new tool to generate 3d conformation of small molecules using distance geometry and automated molecular mechanics optimization for in silico screening.

  BMC chemical biology 20090101

• Selective sigma-2 ligands preferentially bind to pancreatic adenocarcinomas: applications in diagnostic imaging and therapy.

  Molecular cancer 20070101

• Field evaluation of deet, Repel Care, and three plant based essential oil repellents against mosquitoes, black flies (Diptera: Simuliidae) and land leeches (Arhynchobdellida: Haemadipsidae) in Thailand.

  Journal of the American Mosquito Control Association 20060601

• Reactions of (benzamidomethyl)triethylammonium chloride with some inorganic nucleophiles in aqueous media.

  Molecules (Basel, Switzerland) 20060410

• Predictive relationships for the effects of triglyceride ester concentration and water uptake on solubility and partitioning of small molecules into lipid vehicles.

  Journal of pharmaceutical sciences 20041101

• Nucleophilic addition to 3-substituted pyridinium salts: expedient syntheses of (-)-L-733,061 and (-)-CP-99,994.

  Organic letters 20040930

• Design and synthesis of substituted N-methylbenzamide analogues derived from SR 48,968 as neurokinin-2 receptor antagonists.

  Bioorganic & medicinal chemistry letters 20040920

• 5'-substituted-6-carboxylic-2,2'-bipyridine acid: a pivotal architecton for building preorganized ligands.

  The Journal of organic chemistry 20020531

• Thermodynamic analysis of the binding of aromatic hydroxamic acid analogues to ferric horseradish peroxidase.

  Biochemistry 20011120